1 19200  Water Truncated Octahedron (72.684 Ang, 6400 TIP3P)
2     1  O     -5.507074   -1.483141  -25.592821     1     2     3
3     2  H     -4.943301   -2.245003  -25.726827     2     1
4     3  H     -6.289330   -1.669139  -26.112159     2     1
5     4  O      4.973649  -27.228311   -2.580327     1     5     6
6     5  H      4.927050  -27.865997   -3.292660     2     4
7     6  H      4.282919  -26.596030   -2.778680     2     4
8     7  O    -23.455043   -9.286836  -19.458184     1     8     9
9     8  H    -24.048604   -9.928160  -19.067516     2     7
10     9  H    -22.939564   -8.957302  -18.722033     2     7
11    10  O    -16.901808  -26.652578   -1.265370     1    11    12
12    11  H    -16.851872  -26.681810   -2.220819     2    10
13    12  H    -16.871481  -25.719980   -1.051891     2    10
14    13  O     -7.926456  -13.558613  -13.993671     1    14    15
15    14  H     -8.804185  -13.818479  -14.273479     2    13
16    15  H     -8.070169  -12.803692  -13.422995     2    13
17    16  O     -8.078806  -24.369358  -13.552979     1    17    18
18    17  H     -7.846211  -23.547995  -13.985986     2    16
19    18  H     -8.267885  -24.118780  -12.648716     2    16
20    19  O     -0.067406  -22.220278    1.717740     1    20    21
21    20  H     -0.813301  -21.898504    1.211447     2    19
22    21  H     -0.093508  -23.170570    1.605960     2    19
23    22  O     -6.541945  -14.738472   -7.633649     1    23    24
24    23  H     -6.367736  -15.369564   -8.331937     2    22
25    24  H     -6.403755  -13.884043   -8.042411     2    22
26    25  O    -11.778608   -4.745557  -12.341923     1    26    27
27    26  H    -12.357133   -5.124271  -11.680020     2    25
28    27  H    -12.321357   -4.683657  -13.127941     2    25
29    28  O    -11.152671  -27.083499   -6.015576     1    29    30
30    29  H    -10.430971  -27.192938   -6.634773     2    28
31    30  H    -10.921469  -26.302223   -5.513195     2    28
32    31  O     -2.904352  -25.609433  -15.405884     1    32    33
33    32  H     -2.011506  -25.940488  -15.503145     2    31
34    33  H     -2.951669  -25.309886  -14.497994     2    31
35    34  O      0.504431  -25.451513  -15.272570     1    35    36
36    35  H      1.385357  -25.150083  -15.494701     2    34
37    36  H      0.152109  -25.790400  -16.095525     2    34
38    37  O     -7.137537  -27.968618   -9.478984     1    38    39
39    38  H     -7.374813  -27.989096  -10.406082     2    37
40    39  H     -7.126371  -28.888269   -9.213749     2    37
41    40  O    -12.151689   -8.478093  -26.984851     1    41    42
42    41  H    -12.898546   -8.675013  -27.550235     2    40
43    42  H    -11.919901   -7.574515  -27.199447     2    40
44    43  O    -29.278566   -5.823789   -1.417673     1    44    45
45    44  H    -29.581832   -6.726760   -1.512031     2    43
46    45  H    -29.884415   -5.431620   -0.788878     2    43
47    46  O    -26.093135   -8.836846   -6.902057     1    47    48
48    47  H    -26.712821   -9.148540   -7.561653     2    46
49    48  H    -25.280161   -8.691861   -7.386086     2    46
50    49  O    -10.798835  -18.211450  -11.282744     1    50    51
51    50  H    -11.312246  -18.702996  -10.641633     2    49
52    51  H    -11.049159  -18.584856  -12.127810     2    49
53    52  O    -15.226242   -1.202079   31.581819     1    53    54
54    53  H    -16.166500   -1.364795   31.657121     2    52
55    54  H    -15.030683   -0.591452   32.292540     2    52
56    55  O     19.209647   11.243677   23.389762     1    56    57
57    56  H     19.404734   10.310129   23.308147     2    55
58    57  H     19.351453   11.438389   24.316158     2    55
59    58  O     -8.674404   -1.207129  -16.819746     1    59    60
60    59  H     -8.317159   -2.045247  -16.526208     2    58
61    60  H     -8.947072   -0.767249  -16.014520     2    58
62    61  O     -0.827624  -13.750839  -18.300408     1    62    63
63    62  H     -0.933452  -14.540972  -17.770576     2    61
64    63  H     -0.514448  -13.088783  -17.684101     2    61
65    64  O     19.896309   12.872414   21.350424     1    65    66
66    65  H     19.088031   13.031620   20.863012     2    64
67    66  H     19.675748   12.165071   21.956436     2    64
68    67  O     -9.600667  -18.704017  -14.833205     1    68    69
69    68  H    -10.485631  -18.982375  -14.597437     2    67
70    69  H     -9.039262  -19.427409  -14.554350     2    67
71    70  O    -27.340045  -13.509898  -12.965593     1    71    72
72    71  H    -28.071568  -12.939813  -13.202466     2    70
73    72  H    -26.811065  -13.564756  -13.761458     2    70
74    73  O    -34.418889   -0.147510  -16.856771     1    74    75
75    74  H    -34.726517   -1.040595  -17.011678     2    73
76    75  H    -34.590529    0.311453  -17.679039     2    73
77    76  O    -14.682897   -9.186769  -28.201322     1    77    78
78    77  H    -15.261966   -9.687360  -27.626588     2    76
79    78  H    -15.271812   -8.624750  -28.704855     2    76
80    79  O    -25.290172  -21.296718   -3.260278     1    80    81
81    80  H    -25.137416  -21.304930   -2.315381     2    79
82    81  H    -26.145920  -20.879950   -3.361425     2    79
83    82  O    -16.549409  -30.425602   -4.457845     1    83    84
84    83  H    -17.397581  -30.796395   -4.701460     2    82
85    84  H    -16.098109  -30.290904   -5.291161     2    82
86    85  O     -1.345544   -4.616185  -23.349243     1    86    87
87    86  H     -1.401679   -4.070201  -24.133450     2    85
88    87  H     -2.252568   -4.854053  -23.156998     2    85
89    88  O     -4.879782  -25.844340  -23.718899     1    89    90
90    89  H     -5.512464  -25.388020  -24.273622     2    88
91    90  H     -4.115194  -25.970671  -24.280751     2    88
92    91  O    -25.215310   -4.829953  -18.551008     1    92    93
93    92  H    -25.015274   -5.537139  -19.164283     2    91
94    93  H    -26.049892   -4.475359  -18.857549     2    91
95    94  O     -1.412408  -18.708513  -31.646496     1    95    96
96    95  H     -1.626458  -19.450359  -32.212251     2    94
97    96  H     -2.120828  -18.685047  -31.003206     2    94
98    97  O    -32.193040  -12.394110    1.413294     1    98    99
99    98  H    -32.505029  -13.298508    1.444272     2    97
100    99  H    -32.973147  -11.877954    1.210201     2    97
101   100  O    -35.775727    2.408145    1.163497     1   101   102
102   101  H    -34.980392    2.071697    0.750609     2   100
103   102  H    -36.409908    1.696248    1.078354     2   100
104   103  O     -7.421409  -21.721820  -19.929437     1   104   105
105   104  H     -6.494410  -21.730910  -19.691064     2   103
106   105  H     -7.545743  -22.521814  -20.440105     2   103
107   106  O    -14.444982  -30.678125    5.931727     1   107   108
108   107  H    -14.752080  -30.931662    6.802152     2   106
109   108  H    -14.670435  -29.750749    5.858397     2   106
110   109  O    -25.233887  -16.254519   -7.345011     1   110   111
111   110  H    -25.958541  -16.119414   -7.955628     2   109
112   111  H    -25.531366  -15.855352   -6.527452     2   109
113   112  O    -29.079527   -7.651449   -5.270611     1   113   114
114   113  H    -28.840040   -8.577741   -5.299977     2   112
115   114  H    -29.988044   -7.628818   -5.571136     2   112
116   115  O    -17.223620  -25.705834    1.927626     1   116   117
117   116  H    -16.742834  -25.180059    1.288379     2   115
118   117  H    -16.657643  -26.459997    2.092365     2   115
119   118  O    -14.023977  -13.884308    8.055120     1   119   120
120   119  H    -14.668022  -13.559363    7.425955     2   118
121   120  H    -13.177568  -13.646348    7.676704     2   118
122   121  O     35.811057   -3.647493   -1.409367     1   122   123
123   122  H     35.068629   -3.662375   -0.805372     2   121
124   123  H     36.581475   -3.619385   -0.842007     2   121
125   124  O     16.924713   20.219074   16.874879     1   125   126
126   125  H     16.218234   19.666179   17.208685     2   124
127   126  H     17.514597   20.330898   17.620375     2   124
128   127  O     -6.619876  -24.090890   -0.327698     1   128   129
129   128  H     -6.061753  -23.642099   -0.962770     2   127
130   129  H     -6.316877  -23.774980    0.523551     2   127
131   130  O    -16.952319  -23.875862  -10.383338     1   131   132
132   131  H    -16.367539  -24.136354   -9.671715     2   130
133   132  H    -17.148215  -22.955429  -10.208238     2   130
134   133  O     -4.186374  -23.671343  -22.452797     1   134   135
135   134  H     -4.030508  -23.063958  -23.175999     2   133
136   135  H     -4.441559  -24.490154  -22.877840     2   133
137   136  O     -1.266481  -24.231402  -12.761881     1   137   138
138   137  H     -0.743243  -25.013565  -12.586742     2   136
139   138  H     -1.511328  -23.907415  -11.895097     2   136
140   139  O    -26.329513   -1.423991  -20.462181     1   140   141
141   140  H    -26.099358   -1.074610  -19.601255     2   139
142   141  H    -25.522626   -1.828820  -20.780425     2   139
143   142  O    -21.291734  -11.230528   -6.103175     1   143   144
144   143  H    -21.264207  -10.362437   -6.505534     2   142
145   144  H    -20.904607  -11.811110   -6.758376     2   142
146   145  O     -9.766976   -7.209369   -6.981545     1   146   147
147   146  H     -9.434035   -7.792925   -6.299750     2   145
148   147  H     -9.362347   -6.362948   -6.791604     2   145
149   148  O    -18.065070  -11.231247  -19.406632     1   149   150
150   149  H    -17.165483  -11.050794  -19.133845     2   148
151   150  H    -18.260212  -10.553359  -20.053640     2   148
152   151  O    -14.355590  -27.008050  -10.581918     1   152   153
153   152  H    -13.440887  -26.958412  -10.859560     2   151
154   153  H    -14.479599  -26.239049  -10.025600     2   151
155   154  O     -3.990376   -3.495548  -26.712935     1   155   156
156   155  H     -3.035405   -3.472787  -26.651743     2   154
157   156  H     -4.167212   -3.940786  -27.541623     2   154
158   157  O    -15.332710  -21.775187   -0.797921     1   158   159
159   158  H    -14.619480  -21.158842   -0.964210     2   157
160   159  H    -16.040572  -21.483809   -1.372606     2   157
161   160  O    -33.297482   -1.975591   -9.942274     1   161   162
162   161  H    -33.942619   -1.496662   -9.422028     2   160
163   162  H    -33.604083   -1.887865  -10.844788     2   160
164   163  O     -9.989436   -4.017992  -29.295233     1   164   165
165   164  H     -9.469789   -3.362161  -29.760083     2   163
166   165  H    -10.863205   -3.948548  -29.679858     2   163
167   166  O    -25.256144   -0.095777   -1.979889     1   167   168
168   167  H    -25.399195    0.829860   -1.782499     2   166
169   168  H    -25.984315   -0.547452   -1.553288     2   166
170   169  O    -18.790352  -13.459398  -17.372298     1   170   171
171   170  H    -18.946316  -13.124295  -16.489341     2   169
172   171  H    -18.901238  -12.697609  -17.941168     2   169
173   172  O     14.946297   23.465689   10.522593     1   173   174
174   173  H     14.052522   23.204459   10.744307     2   172
175   174  H     15.353963   23.665475   11.365282     2   172
176   175  O     -0.164976  -13.167301  -30.771010     1   176   177
177   176  H     -0.469829  -12.288215  -30.546280     2   175
178   177  H      0.661140  -13.263271  -30.297138     2   175
179   178  O    -25.930241  -21.023556    3.306592     1   179   180
180   179  H    -25.466024  -20.382108    2.768747     2   178
181   180  H    -25.620679  -21.871871    2.989158     2   178
182   181  O    -29.806064    0.238410  -20.992935     1   182   183
183   182  H    -29.681439    0.457125  -20.069428     2   181
184   183  H    -30.222650   -0.623306  -20.981380     2   181
185   184  O     -6.972923  -15.646353  -12.376634     1   185   186
186   185  H     -7.118931  -14.890539  -12.945544     2   184
187   186  H     -7.805214  -15.766974  -11.919497     2   184
188   187  O    -16.528346   -1.967276   -4.747034     1   188   189
189   188  H    -16.723053   -2.503972   -3.978738     2   187
190   189  H    -15.620758   -2.179892   -4.964544     2   187
191   190  O    -11.854680   -6.812885  -31.495877     1   191   192
192   191  H    -11.062773   -7.172356  -31.096009     2   190
193   192  H    -12.022124   -7.380012  -32.248579     2   190
194   193  O    -17.947945  -16.147779  -14.998176     1   194   195
195   194  H    -18.187801  -15.224644  -14.917412     2   193
196   195  H    -17.581402  -16.376122  -14.143929     2   193
197   196  O    -18.095870   -3.831354  -14.806624     1   197   198
198   197  H    -18.884356   -3.639706  -15.314357     2   196
199   198  H    -17.749285   -4.634386  -15.195531     2   196
200   199  O     -6.585876    4.084254  -26.341620     1   200   201
201   200  H     -6.795851    3.152425  -26.403549     2   199
202   201  H     -5.665634    4.105965  -26.079104     2   199
203   202  O    -17.965901  -15.300958   -5.091433     1   203   204
204   203  H    -18.713555  -15.720131   -5.517508     2   202
205   204  H    -18.241596  -14.393627   -4.961147     2   202
206   205  O    -11.770650  -30.248045   -8.862442     1   206   207
207   206  H    -11.074571  -30.200050   -8.207155     2   205
208   207  H    -12.556787  -29.959031   -8.399094     2   205
209   208  O     -2.709737   -7.500662  -13.166229     1   209   210
210   209  H     -3.091769   -6.784490  -13.673555     2   208
211   210  H     -2.126064   -7.068407  -12.542760     2   208
212   211  O     -1.206347   -7.150116  -27.382284     1   212   213
213   212  H     -0.468150   -7.751465  -27.480658     2   211
214   213  H     -1.975684   -7.718475  -27.345936     2   211
215   214  O    -14.834744  -14.333442  -25.061754     1   215   216
216   215  H    -14.885448  -14.577707  -24.137635     2   214
217   216  H    -13.933135  -14.035354  -25.182072     2   214
218   217  O    -19.721068   -5.998678  -18.477041     1   218   219
219   218  H    -19.188154   -5.506352  -19.101420     2   217
220   219  H    -19.119859   -6.210389  -17.762928     2   217
221   220  O    -12.778450   -8.895568  -17.179991     1   221   222
222   221  H    -12.766780   -9.810336  -17.461583     2   220
223   222  H    -12.523009   -8.401403  -17.958953     2   220
224   223  O    -28.218299  -12.414339   -0.787622     1   224   225
225   224  H    -28.433299  -11.514509   -0.542034     2   223
226   225  H    -27.569359  -12.691133   -0.140711     2   223
227   226  O     -0.345920  -16.569207  -28.153117     1   227   228
228   227  H      0.163549  -16.351107  -27.372665     2   226
229   228  H      0.114975  -17.313426  -28.540345     2   226
230   229  O    -21.755817  -13.109367   -2.028483     1   230   231
231   230  H    -22.192532  -12.695237   -2.772801     2   229
232   231  H    -20.936047  -13.447425   -2.388935     2   229
233   232  O    -11.191874   -3.913250   -8.220737     1   233   234
234   233  H    -11.025296   -3.545477   -9.088623     2   232
235   234  H    -11.576627   -3.191189   -7.723922     2   232
236   235  O     -2.817667  -24.931356   -7.814796     1   236   237
237   236  H     -3.205985  -25.795695   -7.950295     2   235
238   237  H     -1.945117  -25.112375   -7.465338     2   235
239   238  O     -3.061492    0.490833  -15.961596     1   239   240
240   239  H     -2.379864    1.132574  -16.161051     2   238
241   240  H     -3.742681    0.994787  -15.516349     2   238
242   241  O    -14.043580   -1.374061   -9.119975     1   242   243
243   242  H    -14.295920   -1.579904   -8.219873     2   241
244   243  H    -14.651728   -1.877847   -9.660888     2   241
245   244  O    -14.945253    0.687642  -27.777213     1   245   246
246   245  H    -14.605913    1.562739  -27.965059     2   244
247   246  H    -15.621276    0.829524  -27.114571     2   244
248   247  O    -12.722877  -13.817152  -20.565227     1   248   249
249   248  H    -13.262165  -13.619928  -19.799393     2   247
250   249  H    -11.944896  -13.269848  -20.458287     2   247
251   250  O    -22.950552   -2.804274    4.118048     1   251   252
252   251  H    -23.276579   -3.561226    4.604835     2   250
253   252  H    -22.568735   -2.235385    4.786488     2   250
254   253  O     11.426200   12.341316   28.016440     1   254   255
255   254  H     11.335283   11.850833   28.833380     2   253
256   255  H     11.895723   13.137410   28.265470     2   253
257   256  O    -30.076741  -10.714151   -8.975041     1   257   258
258   257  H    -30.630182  -11.477904   -8.811898     2   256
259   258  H    -29.654972  -10.539301   -8.133750     2   256
260   259  O    -11.590988  -30.602228  -11.640296     1   260   261
261   260  H    -11.530877  -30.307708  -10.731518     2   259
262   261  H    -12.524408  -30.762169  -11.779495     2   259
263   262  O     34.542789   14.821881    4.943837     1   263   264
264   263  H     34.346875   14.477387    5.815143     2   262
265   264  H     35.498377   14.868329    4.913421     2   262
266   265  O     16.332257   24.388475   12.784693     1   266   267
267   266  H     16.131796   24.238475   13.708569     2   265
268   267  H     17.288278   24.419178   12.748470     2   265
269   268  O    -19.509862  -21.280080   -4.655060     1   269   270
270   269  H    -19.410011  -22.232036   -4.661467     2   268
271   270  H    -20.438601  -21.134970   -4.835666     2   268
272   271  O     -5.533169  -25.631008  -11.800584     1   272   273
273   272  H     -5.538275  -26.388827  -12.385319     2   271
274   273  H     -5.154460  -24.925622  -12.325220     2   271
275   274  O     -0.469909  -33.450972    1.530769     1   275   276
276   275  H      0.044983  -32.644239    1.513419     2   274
277   276  H     -1.117573  -33.307512    2.220828     2   274
278   277  O     -6.238242   -4.488345  -28.852425     1   278   279
279   278  H     -6.120025   -4.881839  -29.716959     2   277
280   279  H     -6.076988   -5.204851  -28.238546     2   277
281   280  O    -21.360731  -19.754899   -2.430352     1   281   282
282   281  H    -21.513491  -20.428921   -1.768090     2   280
283   282  H    -20.418116  -19.788004   -2.593483     2   280
284   283  O      0.680349  -19.879632  -14.754452     1   284   285
285   284  H      0.948671  -20.443025  -14.028626     2   283
286   285  H      1.086194  -20.273514  -15.526708     2   283
287   286  O     -9.456351  -10.599444  -17.463670     1   287   288
288   287  H    -10.108002  -10.111966  -16.959739     2   286
289   288  H     -9.167913   -9.986246  -18.139705     2   286
290   289  O     -3.450059  -32.167173   -2.455996     1   290   291
291   290  H     -3.296766  -32.867075   -3.090716     2   289
292   291  H     -3.625820  -32.623625   -1.633201     2   289
293   292  O     -5.534291  -28.440863  -12.682560     1   293   294
294   293  H     -5.332764  -28.787460  -13.551749     2   292
295   294  H     -6.463506  -28.633277  -12.556990     2   292
296   295  O     -4.141920  -13.277270   -9.816566     1   296   297
297   296  H     -3.763912  -13.720843   -9.057234     2   295
298   297  H     -4.792065  -12.680068   -9.446574     2   295
299   298  O     -2.377790  -19.105477  -27.106015     1   299   300
300   299  H     -2.133028  -18.214174  -26.857213     2   298
301   300  H     -3.155771  -19.295876  -26.581871     2   298
302   301  O     -1.559315   -2.879757  -25.421021     1   302   303
303   302  H     -0.619876   -2.769773  -25.274085     2   301
304   303  H     -1.870464   -2.004109  -25.650497     2   301
305   304  O     -3.550139    1.440617  -34.649271     1   305   306
306   305  H     -3.807464    1.030809  -35.475148     2   304
307   306  H     -2.705441    1.849711  -34.837308     2   304
308   307  O    -20.735360  -12.988710  -11.936275     1   308   309
309   308  H    -21.563720  -13.161982  -11.489028     2   307
310   309  H    -20.076747  -13.020604  -11.242415     2   307
311   310  O     -1.558681  -29.402233   -8.825568     1   311   312
312   311  H     -1.925705  -29.033229   -9.628911     2   310
313   312  H     -2.240884  -29.270121   -8.167255     2   310
314   313  O    -12.916235   -7.649771  -19.639063     1   314   315
315   314  H    -12.508159   -7.131750  -20.332865     2   313
316   315  H    -13.658971   -8.078100  -20.064632     2   313
317   316  O     -8.850175   -4.866326  -33.512205     1   317   318
318   317  H     -8.930101   -4.883767  -32.558508     2   316
319   318  H     -8.822493   -5.788405  -33.767617     2   316
320   319  O      8.203383  -19.663869  -12.158707     1   320   321
321   320  H      8.179053  -18.963568  -11.506620     2   319
322   321  H      8.879401  -20.263096  -11.842231     2   319
323   322  O    -20.516588   -8.628266  -15.801694     1   323   324
324   323  H    -20.811643   -8.358423  -14.932006     2   322
325   324  H    -21.195925   -8.308648  -16.395476     2   322
326   325  O    -16.864467  -16.566851  -12.585770     1   326   327
327   326  H    -16.711132  -15.720899  -12.164955     2   325
328   327  H    -16.059076  -17.060794  -12.432160     2   325
329   328  O    -18.676646    6.476301   -6.767785     1   329   330
330   329  H    -18.728780    5.945650   -7.562721     2   328
331   330  H    -19.584651    6.564110   -6.477876     2   328
332   331  O     31.508952   11.290669    7.687566     1   332   333
333   332  H     32.141317   11.510985    8.371529     2   331
334   333  H     31.873981   10.513457    7.264568     2   331
335   334  O    -35.175095   -0.268812  -13.964530     1   335   336
336   335  H    -34.892069   -0.159554  -14.872379     2   334
337   336  H    -35.882301    0.366951  -13.855458     2   334
338   337  O     -3.144740  -17.248109  -18.817216     1   338   339
339   338  H     -3.243121  -16.374444  -19.195717     2   337
340   339  H     -4.041001  -17.539195  -18.649239     2   337
341   340  O    -26.846052   -4.498824   -1.437009     1   341   342
342   341  H    -26.278900   -5.157165   -1.035565     2   340
343   342  H    -27.715602   -4.898967   -1.436956     2   340
344   343  O     12.927236   10.182781   26.435909     1   344   345
345   344  H     12.487498   11.025963   26.326798     2   343
346   345  H     12.621293    9.860494   27.283707     2   343
347   346  O     -4.962014  -11.597834  -31.294695     1   347   348
348   347  H     -5.536949  -11.221937  -31.961316     2   346
349   348  H     -4.355535  -12.152168  -31.785743     2   346
350   349  O     -8.360371  -32.475696    0.681543     1   350   351
351   350  H     -8.355450  -31.571771    0.996388     2   349
352   351  H     -8.912614  -32.944701    1.307079     2   349
353   352  O    -12.126196  -13.234196  -10.214971     1   353   354
354   353  H    -11.567424  -13.861361   -9.755984     2   352
355   354  H    -11.911761  -12.388577   -9.821046     2   352
356   355  O      1.568985  -23.661282   -7.109724     1   356   357
357   356  H      1.622512  -23.559205   -6.159489     2   355
358   357  H      1.037926  -24.447400   -7.237110     2   355
359   358  O     -3.972402  -33.437608   -0.081967     1   359   360
360   359  H     -3.732911  -34.305184   -0.407832     2   358
361   360  H     -4.415192  -33.607365    0.749508     2   358
362   361  O     -7.399883   -9.431451  -25.032730     1   362   363
363   362  H     -7.964774  -10.148598  -25.320530     2   361
364   363  H     -7.917913   -8.641369  -25.186511     2   361
365   364  O     -8.740672  -22.166201  -16.594423     1   365   366
366   365  H     -9.336216  -22.905400  -16.471367     2   364
367   366  H     -9.270265  -21.502268  -17.035962     2   364
368   367  O     -2.456323   -0.182240  -26.243264     1   368   369
369   368  H     -2.281752   -0.478974  -27.136408     2   367
370   369  H     -1.720120    0.392252  -26.033036     2   367
371   370  O     31.209515   -3.063468   -2.259830     1   371   372
372   371  H     32.070182   -2.722820   -2.503640     2   370
373   372  H     30.829536   -2.381427   -1.706055     2   370
374   373  O    -12.328345  -19.699166   -9.007251     1   374   375
375   374  H    -13.231423  -19.389504   -9.076453     2   373
376   375  H    -11.936847  -19.147849   -8.329747     2   373
377   376  O    -16.204302  -24.412276   -3.526094     1   377   378
378   377  H    -17.032060  -23.935271   -3.585373     2   376
379   378  H    -16.357704  -25.220810   -4.014943     2   376
380   379  O    -19.711712  -24.602388    1.998703     1   380   381
381   380  H    -20.314970  -25.036829    2.601671     2   379
382   381  H    -18.938432  -25.166377    1.985023     2   379
383   382  O    -17.031096   -3.292738   -2.506766     1   383   384
384   383  H    -17.181386   -2.609781   -1.853150     2   382
385   384  H    -17.755485   -3.906221   -2.383760     2   382
386   385  O    -30.854105   -6.204989  -13.752858     1   386   387
387   386  H    -30.617528   -6.745055  -12.998808     2   385
388   387  H    -30.125067   -6.313071  -14.363640     2   385
389   388  O     -3.524898   33.672007    3.874914     1   389   390
390   389  H     -4.062957   34.152042    4.504429     2   388
391   390  H     -2.709059   33.494194    4.342910     2   388
392   391  O    -18.249628   -6.900817  -16.198087     1   392   393
393   392  H    -18.777373   -7.699251  -16.212933     2   391
394   393  H    -17.408604   -7.175794  -15.832987     2   391
395   394  O     -5.889753  -22.847756  -16.777629     1   395   396
396   395  H     -5.370800  -22.238286  -17.302479     2   394
397   396  H     -6.774387  -22.482392  -16.790375     2   394
398   397  O    -15.089767  -16.186566   -3.682216     1   398   399
399   398  H    -15.021585  -15.409199   -3.127884     2   397
400   399  H    -15.759309  -15.962466   -4.328531     2   397
401   400  O     35.300619    0.386176   -9.177314     1   401   402
402   401  H     36.036582    0.016653   -9.665210     2   400
403   402  H     34.580173   -0.225239   -9.330162     2   400
404   403  O     -8.509736   -5.774283  -30.840717     1   404   405
405   404  H     -8.770238   -6.612683  -30.459332     2   403
406   405  H     -8.873650   -5.117275  -30.247304     2   403
407   406  O     -6.302485   -8.138091   34.392711     1   407   408
408   407  H     -6.364870   -7.350751   33.851939     2   406
409   408  H     -5.777959   -8.746114   33.871740     2   406
410   409  O    -21.322219   -6.173814  -23.561367     1   410   411
411   410  H    -20.737520   -6.893241  -23.323077     2   409
412   411  H    -22.187874   -6.577897  -23.621282     2   409
413   412  O      5.050775   -6.026044  -21.454323     1   413   414
414   413  H      4.808791   -5.187608  -21.061004     2   412
415   414  H      4.258400   -6.559122  -21.389505     2   412
416   415  O    -11.898251  -13.565181  -25.466516     1   416   417
417   416  H    -11.474306  -13.943558  -24.696235     2   415
418   417  H    -11.551926  -12.674301  -25.517731     2   415
419   418  O     -9.326050   -3.481164  -13.367762     1   419   420
420   419  H    -10.022411   -3.972251  -12.931705     2   418
421   420  H     -9.772188   -2.732854  -13.764279     2   418
422   421  O     34.958198   -3.938024   -5.537774     1   422   423
423   422  H     34.611992   -4.827928   -5.604428     2   421
424   423  H     34.308143   -3.465971   -5.017365     2   421
425   424  O     -8.015248  -15.882749  -17.924392     1   425   426
426   425  H     -7.798256  -16.146736  -18.818516     2   424
427   426  H     -7.716030  -16.610898  -17.379875     2   424
428   427  O     -6.620917  -26.775949  -16.663832     1   428   429
429   428  H     -7.409949  -26.946448  -17.178216     2   427
430   429  H     -6.307449  -25.928249  -16.979069     2   427
431   430  O    -15.863595  -16.691860  -18.529256     1   431   432
432   431  H    -15.645744  -17.176635  -17.733162     2   430
433   432  H    -15.721484  -15.774007  -18.297779     2   430
434   433  O    -12.416907  -13.742765   -6.022507     1   434   435
435   434  H    -11.598934  -13.697117   -6.517550     2   433
436   435  H    -12.141294  -13.781930   -5.106682     2   433
437   436  O    -20.636228   -3.100291  -15.739109     1   437   438
438   437  H    -21.341680   -2.479906  -15.922663     2   436
439   438  H    -20.885129   -3.893818  -16.213023     2   436
440   439  O    -26.096466    2.460496  -12.700261     1   440   441
441   440  H    -25.981114    1.861195  -11.962857     2   439
442   441  H    -26.708040    2.009694  -13.282487     2   439
443   442  O     23.199110   25.642974   -1.761644     1   443   444
444   443  H     23.010012   26.551607   -1.527422     2   442
445   444  H     24.095491   25.498571   -1.458526     2   442
446   445  O     10.997233   29.810369    9.888734     1   446   447
447   446  H     10.431394   29.232596   10.400824     2   445
448   447  H     10.926341   30.661112   10.321680     2   445
449   448  O    -19.849092  -10.367672   -1.229578     1   449   450
450   449  H    -20.802752  -10.401382   -1.304599     2   448
451   450  H    -19.549878  -10.090702   -2.095598     2   448
452   451  O     -7.839767  -19.706760    6.332467     1   452   453
453   452  H     -7.139932  -20.287374    6.631381     2   451
454   453  H     -7.625294  -18.855810    6.714722     2   451
455   454  O    -25.424699   -5.414998   -7.720909     1   455   456
456   455  H    -24.542930   -5.119122   -7.947124     2   454
457   456  H    -25.594042   -6.143466   -8.318311     2   454
458   457  O    -15.091479   -7.953633   -8.252037     1   458   459
459   458  H    -15.215709   -8.391738   -7.410098     2   457
460   459  H    -15.768556   -7.277346   -8.272876     2   457
461   460  O     -9.207674  -15.828631  -10.720666     1   461   462
462   461  H     -9.784313  -16.590835  -10.773244     2   460
463   462  H     -9.620985  -15.259335  -10.071583     2   460
464   463  O    -28.615358   -1.283595    5.962108     1   464   465
465   464  H    -28.639848   -0.577854    5.315918     2   463
466   465  H    -29.513312   -1.613868    5.990921     2   463
467   466  O     -0.599443  -19.489428  -22.780721     1   467   468
468   467  H     -0.582245  -20.122456  -22.062939     2   466
469   468  H     -0.970275  -18.696799  -22.392834     2   466
470   469  O     12.593091    3.189112   31.827582     1   470   471
471   470  H     12.285443    4.068212   31.606746     2   469
472   471  H     11.861155    2.614991   31.602004     2   469
473   472  O    -22.316877   -2.547571   -7.021657     1   473   474
474   473  H    -21.879398   -1.958558   -6.406916     2   472
475   474  H    -23.175634   -2.708019   -6.630473     2   472
476   475  O     -1.085260  -11.407632  -24.938382     1   476   477
477   476  H     -1.107739  -12.037788  -25.658541     2   475
478   477  H     -1.100977  -11.946474  -24.147412     2   475
479   478  O     21.333106   15.862007   15.946501     1   479   480
480   479  H     22.037566   15.321126   15.589548     2   478
481   480  H     21.767151   16.668592   16.224454     2   478
482   481  O      0.664630  -26.795630   -9.141600     1   482   483
483   482  H      1.394489  -26.211419   -9.347115     2   481
484   483  H      0.229339  -26.940553   -9.981690     2   481
485   484  O    -11.134986   -9.587834  -12.984630     1   485   486
486   485  H    -12.026997   -9.925511  -12.903876     2   484
487   486  H    -11.138283   -9.095088  -13.805253     2   484
488   487  O     -2.472797  -20.790881   -4.236882     1   488   489
489   488  H     -2.937701  -21.275247   -4.919147     2   487
490   489  H     -3.166229  -20.407678   -3.699724     2   487
491   490  O    -32.264397   -2.761424  -15.655680     1   491   492
492   491  H    -31.539546   -2.469399  -15.102921     2   490
493   492  H    -32.721937   -1.955972  -15.896796     2   490
494   493  O      8.932026  -31.993716  -11.637392     1   494   495
495   494  H      9.745712  -31.710867  -11.220085     2   493
496   495  H      9.215491  -32.542779  -12.368425     2   493
497   496  O    -10.605640  -14.559227   -8.469083     1   497   498
498   497  H    -10.504440  -15.282593   -7.850430     2   496
499   498  H    -10.002208  -13.886823   -8.152893     2   496
500   499  O      5.595403  -22.183348   -9.575005     1   500   501
501   500  H      5.532872  -21.512833  -10.255248     2   499
502   501  H      4.903287  -21.959347   -8.952888     2   499
503   502  O    -29.883139   -1.876239  -14.466887     1   503   504
504   503  H    -29.264131   -1.390816  -15.012254     2   502
505   504  H    -29.426618   -2.689486  -14.251367     2   502
506   505  O    -21.080358  -25.152781   -2.744465     1   506   507
507   506  H    -21.146962  -25.368810   -1.814344     2   505
508   507  H    -20.520899  -24.376555   -2.771092     2   505
509   508  O      0.027505  -10.811794   -6.003769     1   509   510
510   509  H      0.895891  -11.169955   -5.819763     2   508
511   510  H     -0.293583  -11.328567   -6.742741     2   508
512   511  O    -32.512265   19.009491   -0.425387     1   512   513
513   512  H    -31.860435   19.489743   -0.935982     2   511
514   513  H    -32.794001   19.629094    0.247627     2   511
515   514  O    -23.059400  -22.866631   -0.287321     1   515   516
516   515  H    -23.583747  -23.664221   -0.359031     2   514
517   516  H    -22.172488  -23.140697   -0.520784     2   514
518   517  O    -23.074076    0.300791  -20.122331     1   518   519
519   518  H    -23.859398    0.763736  -20.414192     2   517
520   519  H    -22.933490    0.607747  -19.226649     2   517
521   520  O     12.341637   23.360872   14.213223     1   521   522
522   521  H     12.527438   24.299865   14.214657     2   520
523   522  H     12.359912   23.114027   13.288580     2   520
524   523  O    -11.804905    3.164641   -5.407711     1   524   525
525   524  H    -11.245368    2.408099   -5.583193     2   523
526   525  H    -12.127889    3.429196   -6.269061     2   523
527   526  O    -28.058324   -1.058275  -16.850907     1   527   528
528   527  H    -27.270726   -1.213453  -17.372290     2   526
529   528  H    -27.983195   -0.146905  -16.568078     2   526
530   529  O     15.950542   15.848782   15.685435     1   530   531
531   530  H     16.771824   16.010472   15.221125     2   529
532   531  H     15.271055   15.981040   15.024348     2   529
533   532  O     -2.774866  -14.619476  -11.858880     1   533   534
534   533  H     -3.408361  -14.418252  -12.547666     2   532
535   534  H     -3.159970  -14.251352  -11.063637     2   532
536   535  O     -0.306865  -21.349789  -20.343468     1   536   537
537   536  H     -0.422893  -22.293442  -20.232622     2   535
538   537  H      0.641347  -21.228804  -20.393348     2   535
539   538  O    -21.049674  -26.278519   -6.148599     1   539   540
540   539  H    -21.890067  -26.165468   -5.704537     2   538
541   540  H    -21.042361  -27.196921   -6.418256     2   538
542   541  O    -18.099336   -9.983782   -6.123753     1   542   543
543   542  H    -18.764921   -9.535401   -6.645463     2   541
544   543  H    -17.992577  -10.833989   -6.550346     2   541
545   544  O     13.176689   31.962245    5.188348     1   545   546
546   545  H     12.715231   32.347081    5.933459     2   544
547   546  H     12.604057   32.128478    4.439555     2   544
548   547  O      8.622012  -16.902608   -8.370959     1   548   549
549   548  H      9.436596  -16.607105   -8.777606     2   547
550   549  H      8.714317  -16.664833   -7.448368     2   547
551   550  O     -0.428281  -25.760338   -6.959492     1   551   552
552   551  H     -0.378566  -26.448976   -6.296515     2   550
553   552  H     -0.172030  -26.192593   -7.774184     2   550
554   553  O    -15.911772    4.040693   -6.283191     1   554   555
555   554  H    -15.866670    4.987635   -6.415466     2   553
556   555  H    -16.523319    3.928902   -5.555356     2   553
557   556  O      1.768227  -33.483502   18.702049     1   557   558
558   557  H      2.384518  -34.040987   19.177051     2   556
559   558  H      1.683603  -32.700927   19.246700     2   556
560   559  O    -31.192938   -3.429202   -5.922484     1   560   561
561   560  H    -31.138247   -2.890027   -6.711490     2   559
562   561  H    -30.282204   -3.565174   -5.661127     2   559
563   562  O    -35.947120   -7.661329   -1.861950     1   563   564
564   563  H    -36.842816   -7.682354   -1.525028     2   562
565   564  H    -35.836623   -6.770548   -2.194414     2   562
566   565  O    -11.385523  -27.623222   -2.697533     1   566   567
567   566  H    -12.278512  -27.735412   -2.371628     2   565
568   567  H    -11.132727  -28.492343   -3.008908     2   565
569   568  O    -28.846193  -10.558340   -6.372025     1   569   570
570   569  H    -28.055613  -11.056834   -6.578708     2   568
571   570  H    -29.010171  -10.741162   -5.446867     2   568
572   571  O    -10.029258    1.623437   -9.511776     1   572   573
573   572  H     -9.219099    1.339490   -9.088398     2   571
574   573  H    -10.656219    0.925247   -9.322879     2   571
575   574  O     -8.214596  -18.132996  -27.305160     1   575   576
576   575  H     -7.957710  -18.956445  -27.720097     2   574
577   576  H     -8.736232  -17.682172  -27.969152     2   574
578   577  O     22.897207   22.598911    6.000289     1   578   579
579   578  H     23.082475   22.008532    6.730604     2   577
580   579  H     22.247554   23.211256    6.345564     2   577
581   580  O     13.754303    4.287651   34.508278     1   581   582
582   581  H     14.040542    5.119179   34.130311     2   580
583   582  H     13.649601    3.705394   33.755785     2   580
584   583  O     21.790279   25.166780    6.205442     1   584   585
585   584  H     22.170411   25.870320    6.731524     2   583
586   585  H     20.883717   25.437992    6.061147     2   583
587   586  O    -25.542776   -8.076980  -17.137114     1   587   588
588   587  H    -26.305532   -7.765469  -17.624348     2   586
589   588  H    -25.851779   -8.860993  -16.683163     2   586
590   589  O    -10.845627    0.112586   -6.351245     1   590   591
591   590  H     -9.955908   -0.220754   -6.467505     2   589
592   591  H    -11.274237   -0.049159   -7.191699     2   589
593   592  O    -16.409645  -29.143308   -0.660559     1   593   594
594   593  H    -16.477650  -28.190471   -0.721449     2   592
595   594  H    -17.062188  -29.470533   -1.279707     2   592
596   595  O     -5.981560  -21.269383   -1.874484     1   596   597
597   596  H     -6.108219  -22.091922   -2.347367     2   595
598   597  H     -6.136645  -20.589350   -2.530026     2   595
599   598  O    -10.178737   -2.746355  -10.524303     1   599   600
600   599  H     -9.618203   -2.068720  -10.902252     2   598
601   600  H     -9.906502   -3.553778  -10.960408     2   598
602   601  O     -6.013035  -11.308990   -9.056675     1   602   603
603   602  H     -6.966944  -11.376901   -9.015727     2   601
604   603  H     -5.850396  -10.541938   -9.605685     2   601
605   604  O     -4.553316   -7.459457  -36.188539     1   605   606
606   605  H     -3.957074   -8.197036  -36.317785     2   604
607   606  H     -5.035943   -7.393766  -37.012545     2   604
608   607  O    -21.266131   -3.915237  -13.158166     1   608   609
609   608  H    -20.827717   -3.776998  -13.997758     2   607
610   609  H    -21.554809   -3.042406  -12.891590     2   607
611   610  O     16.444329   25.153872    8.795220     1   611   612
612   611  H     16.057786   24.499664    9.377310     2   610
613   612  H     16.484719   24.721948    7.941966     2   610
614   613  O    -27.198385  -18.382549   -5.753451     1   614   615
615   614  H    -27.154980  -19.319380   -5.945012     2   613
616   615  H    -27.010284  -18.320113   -4.816994     2   613
617   616  O    -18.567499  -18.656783   -1.308536     1   617   618
618   617  H    -18.496439  -18.807771   -0.365995     2   616
619   618  H    -19.159159  -17.908526   -1.387784     2   616
620   619  O      4.455463   -2.465788  -16.715871     1   620   621
621   620  H      4.531409   -2.565079  -15.766869     2   619
622   621  H      4.283007   -3.350961  -17.036743     2   619
623   622  O     -7.342175  -16.351702  -25.632659     1   623   624
624   623  H     -6.546818  -16.061372  -26.079144     2   622
625   624  H     -7.710965  -17.020312  -26.209881     2   622
626   625  O    -17.126618   -4.169640  -22.668139     1   626   627
627   626  H    -17.256278   -4.760170  -23.410226     2   625
628   627  H    -16.203642   -3.920884  -22.717802     2   625
629   628  O     -3.605901  -22.442887   -6.130460     1   629   630
630   629  H     -4.153848  -22.894481   -6.772370     2   628
631   630  H     -2.937327  -23.084915   -5.891628     2   628
632   631  O     -4.515625  -29.385532   -8.392002     1   632   633
633   632  H     -4.465267  -28.727425   -7.698756     2   631
634   633  H     -5.321219  -29.868142   -8.206698     2   631
635   634  O    -13.468492  -19.867360  -16.846546     1   635   636
636   635  H    -13.300261  -20.565215  -16.213357     2   634
637   636  H    -14.276003  -19.454773  -16.540069     2   634
638   637  O     19.043944   31.247757    1.072420     1   638   639
639   638  H     19.877974   31.584287    0.744741     2   637
640   639  H     18.840738   31.802257    1.825724     2   637
641   640  O    -11.897130   -9.201292  -32.790286     1   641   642
642   641  H    -12.146336  -10.068602  -32.471067     2   640
643   642  H    -11.513415   -9.363849  -33.652011     2   640
644   643  O    -16.358639  -33.419699    0.450243     1   644   645
645   644  H    -16.845006  -33.528960   -0.366910     2   643
646   645  H    -17.003547  -33.586821    1.137554     2   643
647   646  O    -16.229135  -14.649423  -10.957034     1   647   648
648   647  H    -16.428687  -13.922749  -10.366818     2   646
649   648  H    -15.339703  -14.912966  -10.721050     2   646
650   649  O    -17.014648   -5.954500   -9.519244     1   650   651
651   650  H    -17.944297   -6.010110   -9.298127     2   649
652   651  H    -16.994644   -5.963124  -10.476197     2   649
653   652  O    -12.136155   -8.929594   -6.847009     1   653   654
654   653  H    -12.251773   -8.207069   -7.464116     2   652
655   654  H    -12.071783   -8.506112   -5.991000     2   652
656   655  O     -7.022706   -3.215360  -16.046896     1   656   657
657   656  H     -6.368011   -2.611594  -16.397713     2   655
658   657  H     -6.622202   -4.080423  -16.133469     2   655
659   658  O    -14.132258  -27.343661   -2.377590     1   659   660
660   659  H    -15.047360  -27.600658   -2.490598     2   658
661   660  H    -14.068228  -26.489732   -2.805301     2   658
662   661  O      5.930171  -28.043124   -8.609425     1   662   663
663   662  H      5.746123  -28.696547   -7.934593     2   661
664   663  H      6.826199  -28.231890   -8.888232     2   661
665   664  O    -14.267959  -17.717834  -11.396051     1   665   666
666   665  H    -14.502319  -18.383191  -10.749053     2   664
667   666  H    -14.226016  -16.902091  -10.897016     2   664
668   667  O    -12.927943   -1.026403  -15.703425     1   668   669
669   668  H    -12.580166   -1.572071  -16.408783     2   667
670   669  H    -13.812609   -1.360600  -15.555403     2   667
671   670  O    -17.901148   -6.293055  -24.636446     1   671   672
672   671  H    -17.124182   -6.344618  -25.193129     2   670
673   672  H    -17.992585   -7.172573  -24.269950     2   670
674   673  O     -3.059465   -9.076657  -27.958983     1   674   675
675   674  H     -4.003009   -9.129992  -27.806955     2   673
676   675  H     -2.856970   -9.850501  -28.484713     2   673
677   676  O     -7.286862  -30.654499   -8.951402     1   677   678
678   677  H     -7.478586  -31.144473   -8.151778     2   676
679   678  H     -7.943099  -30.954963   -9.580137     2   676
680   679  O      2.117903   -7.092374  -28.439293     1   680   681
681   680  H      1.610416   -7.386897  -29.195563     2   679
682   681  H      2.279369   -7.888939  -27.933679     2   679
683   682  O     -5.698183  -29.408369    1.871230     1   683   684
684   683  H     -6.489782  -29.379134    1.333877     2   682
685   684  H     -5.959041  -29.015848    2.704364     2   682
686   685  O     -4.613793  -20.300841  -25.804971     1   686   687
687   686  H     -4.834044  -20.668916  -26.660683     2   685
688   687  H     -5.231663  -20.712140  -25.200571     2   685
689   688  O    -11.836990   -3.147303   -5.273787     1   689   690
690   689  H    -11.818455   -3.611782   -4.437039     2   688
691   690  H    -11.133730   -2.501558   -5.205446     2   688
692   691  O    -27.888724    0.292139  -12.850017     1   692   693
693   692  H    -27.588055   -0.208297  -12.091470     2   691
694   693  H    -27.289921    0.043557  -13.554200     2   691
695   694  O     -9.274861  -24.039591   -1.288084     1   695   696
696   695  H     -8.383214  -23.941503   -0.954054     2   694
697   696  H     -9.466924  -24.972104   -1.189274     2   694
698   697  O     -7.824348  -27.139316  -18.863605     1   698   699
699   698  H     -8.312600  -27.549003  -19.577746     2   697
700   699  H     -8.231585  -26.279692  -18.756660     2   697
701   700  O    -11.971386  -21.804471   -4.078508     1   701   702
702   701  H    -12.282217  -22.675845   -3.832901     2   700
703   702  H    -11.019149  -21.857513   -3.996876     2   700
704   703  O    -15.224965  -11.980296   -9.544640     1   704   705
705   704  H    -14.684643  -12.360241   -8.851874     2   703
706   705  H    -15.412590  -11.091622   -9.242504     2   703
707   706  O      6.164525   28.820061   13.160071     1   707   708
708   707  H      7.046588   28.599691   13.459459     2   706
709   708  H      6.303063   29.405236   12.415350     2   706
710   709  O     -4.681876  -25.208963  -17.529143     1   710   711
711   710  H     -5.085354  -24.344280  -17.605035     2   709
712   711  H     -4.044848  -25.115215  -16.820879     2   709
713   712  O     -3.645323  -30.252147    0.425838     1   713   714
714   713  H     -4.489066  -29.941443    0.754154     2   712
715   714  H     -3.779548  -31.186163    0.265125     2   712
716   715  O    -23.694576  -22.974081   -5.370000     1   716   717
717   716  H    -22.739008  -22.944393   -5.417327     2   715
718   717  H    -23.925909  -22.280671   -4.752019     2   715
719   718  O    -18.854992   -8.808727  -10.068988     1   719   720
720   719  H    -18.338814   -9.104409  -10.818897     2   718
721   720  H    -18.834086   -7.853394  -10.124951     2   718
722   721  O     -5.667947  -23.048122   -8.257686     1   722   723
723   722  H     -5.657278  -23.927005   -8.636742     2   721
724   723  H     -5.110952  -22.529578   -8.838289     2   721
725   724  O     -2.131509  -11.529061  -20.239388     1   725   726
726   725  H     -1.499383  -12.190039  -20.521800     2   724
727   726  H     -1.993122  -10.793981  -20.836664     2   724
728   727  O     -9.903646  -24.694607  -16.125235     1   728   729
729   728  H    -10.779570  -25.072009  -16.044263     2   727
730   729  H     -9.617924  -24.555355  -15.222349     2   727
731   730  O    -10.394853   -5.486122  -18.267889     1   731   732
732   731  H     -9.667451   -6.081775  -18.088122     2   730
733   732  H    -10.799275   -5.336438  -17.413331     2   730
734   733  O      0.004687   -8.037806  -30.020751     1   734   735
735   734  H     -0.379501   -8.694732  -29.440166     2   733
736   735  H     -0.600841   -7.297621  -29.979597     2   733
737   736  O     -0.318173  -21.156604  -10.257885     1   737   738
738   737  H      0.519242  -21.099316  -10.717979     2   736
739   738  H     -0.958519  -20.814013  -10.881440     2   736
740   739  O     14.555843   22.226771   16.930548     1   740   741
741   740  H     15.406266   21.806580   17.058814     2   739
742   741  H     14.055259   21.600657   16.407452     2   739
743   742  O    -13.728631  -10.898489   -3.610210     1   743   744
744   743  H    -14.539602  -10.544120   -3.974875     2   742
745   744  H    -13.793501  -10.728188   -2.670518     2   742
746   745  O      1.725069  -26.007103  -25.821845     1   746   747
747   746  H      1.524345  -25.387665  -26.523442     2   745
748   747  H      1.157842  -26.758342  -25.995411     2   745
749   748  O     -3.717841  -18.659608   -2.225339     1   749   750
750   749  H     -4.546624  -18.413103   -2.635932     2   748
751   750  H     -3.937881  -18.796473   -1.303883     2   748
752   751  O    -11.335959  -30.273330   -3.298832     1   752   753
753   752  H    -12.211860  -30.630324   -3.151917     2   751
754   753  H    -10.770419  -30.776254   -2.712773     2   751
755   754  O     -8.414972  -28.986112  -11.715441     1   755   756
756   755  H     -8.631682  -29.789550  -11.242412     2   754
757   756  H     -8.959799  -29.016261  -12.501879     2   754
758   757  O     -5.548867   -7.762513   -8.484910     1   758   759
759   758  H     -5.064520   -8.477885   -8.072742     2   757
760   759  H     -5.674212   -8.047735   -9.389990     2   757
761   760  O     -3.003237   -8.218111  -10.208758     1   761   762
762   761  H     -2.797975   -8.726005   -9.423811     2   760
763   762  H     -3.834657   -8.578471  -10.517163     2   760
764   763  O    -10.035143   -8.339994  -10.733975     1   764   765
765   764  H     -9.241978   -8.665757  -11.159415     2   763
766   765  H    -10.737428   -8.533998  -11.354773     2   763
767   766  O    -13.809499  -15.518817   -9.860564     1   767   768
768   767  H    -13.205990  -14.800359  -10.049843     2   766
769   768  H    -13.918046  -15.496888   -8.909791     2   766
770   769  O     -5.556114  -25.863431   -9.165303     1   770   771
771   770  H     -6.056401  -26.665054   -9.012516     2   769
772   771  H     -5.552448  -25.760536  -10.116949     2   769
773   772  O     -4.356950  -20.598414  -17.018090     1   773   774
774   773  H     -3.450616  -20.782876  -17.264594     2   772
775   774  H     -4.536536  -19.735767  -17.392014     2   772
776   775  O    -21.993178  -15.645978   -8.777989     1   776   777
777   776  H    -22.319294  -15.229854   -7.980041     2   775
778   777  H    -21.634643  -16.482983   -8.482850     2   775
779   778  O     -1.997449   -9.042938   -7.805542     1   779   780
780   779  H     -1.149903   -9.299162   -7.441884     2   778
781   780  H     -2.249422   -8.267718   -7.303770     2   778
782   781  O    -23.417416  -14.117500  -11.865371     1   782   783
783   782  H    -23.225299  -15.049565  -11.762522     2   781
784   783  H    -24.079902  -13.934090  -11.199260     2   781
785   784  O    -13.487766  -25.553741   -7.476832     1   785   786
786   785  H    -13.021620  -24.720945   -7.550257     2   784
787   786  H    -12.861519  -26.143042   -7.056391     2   784
788   787  O      0.365767    4.547777    1.067191     1   788   789
789   788  H      0.977694    4.520133    0.331655     2   787
790   789  H     -0.388599    4.038398    0.771054     2   787
791   790  O      1.258305   -2.845325  -25.047607     1   791   792
792   791  H      1.756168   -3.113785  -25.819807     2   790
793   792  H      1.371593   -3.565090  -24.426852     2   790
794   793  O     27.573842   17.905780    3.753442     1   794   795
795   794  H     28.094332   18.386603    4.396973     2   793
796   795  H     28.214889   17.578951    3.122194     2   793
797   796  O     -1.057746  -26.707473  -17.342651     1   797   798
798   797  H     -0.465494  -27.248470  -17.864945     2   796
799   798  H     -1.869107  -27.213439  -17.298784     2   796
800   799  O    -14.714240   -6.475383  -16.542550     1   800   801
801   800  H    -14.782053   -5.896914  -17.302160     2   799
802   801  H    -13.800455   -6.760363  -16.538736     2   799
803   802  O    -22.291045    2.257317  -14.161645     1   803   804
804   803  H    -21.470925    2.246654  -13.668166     2   802
805   804  H    -22.610111    1.355997  -14.116364     2   802
806   805  O     -8.108151   -0.249052  -19.136103     1   806   807
807   806  H     -8.345516   -0.521355  -18.249683     2   805
808   807  H     -7.257282   -0.658423  -19.293164     2   805
809   808  O    -10.332097  -32.049757   -1.621751     1   809   810
810   809  H    -10.665215  -32.864891   -1.997012     2   808
811   810  H     -9.647103  -32.327797   -1.013714     2   808
812   811  O     -9.196204  -31.598409  -11.189243     1   812   813
813   812  H     -9.347385  -32.273818  -10.528033     2   811
814   813  H    -10.072987  -31.307666  -11.440144     2   811
815   814  O      2.819496   -4.794453  -15.731988     1   815   816
816   815  H      2.355760   -5.562395  -16.065822     2   814
817   816  H      2.178843   -4.085264  -15.785329     2   814
818   817  O     -6.333809  -26.641918    0.084257     1   818   819
819   818  H     -6.267773  -25.731717   -0.204544     2   817
820   819  H     -6.056848  -26.623726    1.000331     2   817
821   820  O    -17.729750   -6.441489   -5.989360     1   821   822
822   821  H    -18.339142   -6.367177   -5.254955     2   820
823   822  H    -16.954521   -6.861208   -5.616416     2   820
824   823  O     -9.677097  -15.625788   -2.834413     1   824   825
825   824  H     -8.737600  -15.802502   -2.882891     2   823
826   825  H     -9.766621  -14.720295   -3.131564     2   823
827   826  O    -35.446182   -0.686819  -11.071233     1   827   828
828   827  H    -35.214500    0.160012  -11.452588     2   826
829   828  H    -35.876715   -1.160725  -11.782770     2   826
830   829  O     -5.160602  -16.530423  -29.015072     1   830   831
831   830  H     -4.768078  -15.927469  -29.646422     2   829
832   831  H     -4.930950  -16.165898  -28.160313     2   829
833   832  O     -1.254154  -17.214139  -12.335476     1   833   834
834   833  H     -0.723287  -17.019080  -13.107722     2   832
835   834  H     -1.717298  -16.397227  -12.150049     2   832
836   835  O     -3.605575  -18.562494  -29.793585     1   836   837
837   836  H     -4.253546  -17.901611  -29.549455     2   835
838   837  H     -3.288463  -18.907489  -28.958930     2   835
839   838  O     -1.291461  -12.281137  -33.423531     1   839   840
840   839  H     -1.379025  -12.836083  -34.198515     2   838
841   840  H     -1.068031  -12.887989  -32.717811     2   838
842   841  O    -21.821613   -9.402988  -10.263315     1   842   843
843   842  H    -21.808218   -9.636880  -11.191403     2   841
844   843  H    -20.968135   -8.999508  -10.105165     2   841
845   844  O    -15.932645  -14.509842  -21.881549     1   845   846
846   845  H    -15.516809  -15.200412  -21.365385     2   844
847   846  H    -16.829353  -14.816958  -22.015066     2   844
848   847  O    -16.823309   -1.394684  -10.160518     1   848   849
849   848  H    -17.043526   -0.584295   -9.701164     2   847
850   849  H    -16.668163   -1.123185  -11.065200     2   847
851   850  O     -1.944962  -27.952464  -23.379389     1   851   852
852   851  H     -2.487186  -28.695096  -23.113455     2   850
853   852  H     -1.571158  -27.623348  -22.561963     2   850
854   853  O    -11.716634  -14.110458  -16.279546     1   854   855
855   854  H    -11.264744  -13.701264  -15.541584     2   853
856   855  H    -11.602171  -15.050445  -16.139707     2   853
857   856  O     -8.163320  -29.606167   -4.936946     1   857   858
858   857  H     -7.297445  -29.983278   -5.092759     2   856
859   858  H     -8.746742  -30.097742   -5.515051     2   856
860   859  O    -15.786679  -11.024674  -15.402264     1   860   861
861   860  H    -15.841521  -11.970575  -15.538265     2   859
862   861  H    -15.961110  -10.647714  -16.264647     2   859
863   862  O    -11.776764  -10.775137   -9.061197     1   863   864
864   863  H    -11.732148  -10.388590   -8.186656     2   862
865   864  H    -12.376178  -10.206574   -9.544592     2   862
866   865  O    -14.372977   -2.614713   -6.152981     1   866   867
867   866  H    -13.473741   -2.892481   -5.978477     2   865
868   867  H    -14.673711   -3.198695   -6.849225     2   865
869   868  O     -0.990477   -3.260732   -4.213154     1   869   870
870   869  H     -0.902699   -2.518493   -4.811157     2   868
871   870  H     -0.620182   -4.001151   -4.693667     2   868
872   871  O     -1.583742  -24.171819   -4.894020     1   872   873
873   872  H     -0.642662  -23.997798   -4.876191     2   871
874   873  H     -1.653188  -25.089270   -5.158010     2   871
875   874  O    -10.405732  -16.137530  -20.492789     1   875   876
876   875  H    -10.517344  -16.557222  -19.639775     2   874
877   876  H    -11.079306  -16.534064  -21.045320     2   874
878   877  O     -5.718966  -18.136070  -17.949382     1   878   879
879   878  H     -6.087339  -18.251149  -17.073431     2   877
880   879  H     -6.368211  -18.524578  -18.535704     2   877
881   880  O     -0.490612  -29.951460    1.773832     1   881   882
882   881  H     -1.013302  -29.489239    1.118562     2   880
883   882  H      0.269081  -30.275385    1.289920     2   880
884   883  O    -18.880255  -19.205812   -8.554115     1   884   885
885   884  H    -19.476620  -18.867443   -7.886218     2   883
886   885  H    -18.498337  -18.424032   -8.953102     2   883
887   886  O    -22.839847   -0.507493  -14.207778     1   887   888
888   887  H    -22.628897   -0.630069  -13.282193     2   886
889   888  H    -23.760720   -0.758696  -14.279353     2   886
890   889  O     -3.658899   -7.369004  -21.014921     1   890   891
891   890  H     -2.900684   -7.496931  -20.444854     2   889
892   891  H     -3.975772   -8.254090  -21.195047     2   889
893   892  O    -18.898119   -3.021163   -9.221636     1   893   894
894   893  H    -18.619006   -3.154113   -8.315737     2   892
895   894  H    -18.095170   -2.790203   -9.688712     2   892
896   895  O    -19.808724   -4.362592  -24.991689     1   896   897
897   896  H    -20.502625   -4.875775  -24.577713     2   895
898   897  H    -19.038700   -4.930276  -24.959613     2   895
899   898  O     -2.241758  -20.070096  -14.652861     1   899   900
900   899  H     -1.403898  -19.635458  -14.493762     2   898
901   900  H     -2.013772  -20.990670  -14.782465     2   898
902   901  O    -14.136347  -22.207759   -9.369977     1   902   903
903   902  H    -15.064575  -22.375712   -9.207451     2   901
904   903  H    -14.129860  -21.512921  -10.028300     2   901
905   904  O    -32.889104    7.024907    9.820699     1   905   906
906   905  H    -32.609669    6.677841   10.667867     2   904
907   906  H    -32.844157    7.975440    9.924129     2   904
908   907  O     -7.506177  -19.027102  -19.713189     1   908   909
909   908  H     -7.796640  -18.819396  -20.601288     2   907
910   909  H     -7.550056  -19.982004  -19.663507     2   907
911   910  O    -16.050667    0.076772  -15.540802     1   911   912
912   911  H    -16.072216   -0.382262  -14.701126     2   910
913   912  H    -15.825654    0.979375  -15.315169     2   910
914   913  O     -5.008711  -18.070028  -13.495401     1   914   915
915   914  H     -5.352018  -17.515644  -12.794665     2   913
916   915  H     -4.252515  -17.589781  -13.832689     2   913
917   916  O    -15.729786   -1.960759  -28.298612     1   917   918
918   917  H    -15.801196   -1.011839  -28.195250     2   916
919   918  H    -15.604253   -2.091008  -29.238564     2   916
920   919  O     34.138588   18.194423   -1.122624     1   920   921
921   920  H     34.914356   18.726250   -0.944929     2   919
922   921  H     34.163937   18.041087   -2.067122     2   919
923   922  O     -4.818248  -28.006520   -2.048527     1   923   924
924   923  H     -4.839853  -27.616713   -1.174561     2   922
925   924  H     -4.573285  -27.284564   -2.627322     2   922
926   925  O    -20.030982  -10.326272  -12.872565     1   926   927
927   926  H    -19.109228  -10.151523  -12.682661     2   925
928   927  H    -20.199332  -11.181856  -12.477765     2   925
929   928  O    -13.076903  -10.891187  -23.847799     1   929   930
930   929  H    -13.677134  -10.155812  -23.724607     2   928
931   930  H    -13.338530  -11.528447  -23.183208     2   928
932   931  O     -9.147144  -13.630569   -6.257847     1   932   933
933   932  H     -9.138868  -13.347647   -5.343452     2   931
934   933  H     -8.464484  -13.106856   -6.677288     2   931
935   934  O    -19.408010   -6.214082   -8.069834     1   935   936
936   935  H    -18.733970   -6.679308   -7.574388     2   934
937   936  H    -19.366766   -5.314628   -7.745006     2   934
938   937  O     30.608962    7.967836   10.155961     1   938   939
939   938  H     29.867058    8.256602   10.687397     2   937
940   939  H     30.857243    7.122331   10.529738     2   937
941   940  O    -15.355165   -9.004566  -24.243607     1   941   942
942   941  H    -15.370174   -8.587896  -25.105229     2   940
943   942  H    -15.265725   -8.277819  -23.627109     2   940
944   943  O    -15.720595   -0.945327  -12.601590     1   944   945
945   944  H    -14.922439   -1.459855  -12.721759     2   943
946   945  H    -15.438763   -0.036788  -12.708168     2   943
947   946  O     -7.693500  -27.898126   -2.662298     1   947   948
948   947  H     -7.973662  -28.650445   -3.183601     2   946
949   948  H     -6.749015  -28.015323   -2.560098     2   946
950   949  O     -7.488285  -12.760368  -17.873294     1   950   951
951   950  H     -8.227933  -12.178949  -17.696928     2   949
952   951  H     -7.786052  -13.622413  -17.582703     2   949
953   952  O    -12.427489    0.962985  -10.909497     1   953   954
954   953  H    -11.768252    1.656892  -10.898076     2   952
955   954  H    -12.416166    0.606559  -10.021204     2   952
956   955  O    -18.011140  -18.727253   -4.482720     1   956   957
957   956  H    -17.534324  -18.488333   -3.687864     2   955
958   957  H    -18.560631  -19.465721   -4.220124     2   955
959   958  O    -12.692671   -1.833014  -12.525288     1   959   960
960   959  H    -12.520275   -1.057968  -11.990672     2   958
961   960  H    -12.290553   -2.553521  -12.040106     2   958
962   961  O     -3.215099  -14.602242  -19.693867     1   962   963
963   962  H     -2.733594  -13.877506  -19.294941     2   961
964   963  H     -4.130409  -14.434570  -19.469531     2   961
965   964  O     -3.045653   -3.712812  -14.782809     1   965   966
966   965  H     -2.679917   -3.015377  -15.326915     2   964
967   966  H     -2.784595   -4.522033  -15.222401     2   964
968   967  O     -2.498053    1.460951  -22.796242     1   968   969
969   968  H     -2.923098    1.559206  -21.944236     2   967
970   969  H     -2.725597    0.574647  -23.077166     2   967
971   970  O    -10.340415  -14.325773  -22.883701     1   971   972
972   971  H     -9.418630  -14.542851  -23.023065     2   970
973   972  H    -10.545263  -14.690218  -22.022627     2   970
974   973  O    -15.751466  -10.060605   -4.974548     1   974   975
975   974  H    -16.537544  -10.018523   -5.519104     2   973
976   975  H    -15.726118   -9.216418   -4.524062     2   973
977   976  O      0.401246  -17.738235   -9.997163     1   977   978
978   977  H     -0.069873  -18.040719  -10.773554     2   976
979   978  H     -0.180350  -17.948326   -9.266519     2   976
980   979  O    -16.996949    0.011689   -6.582583     1   980   981
981   980  H    -16.824647   -0.759370   -6.042201     2   979
982   981  H    -17.921975    0.207429   -6.433439     2   979
983   982  O    -19.703430  -11.385547  -15.514045     1   983   984
984   983  H    -20.554742  -11.347774  -15.950018     2   982
985   984  H    -19.664106  -10.582666  -14.994366     2   982
986   985  O     27.886359    7.682531   14.789896     1   986   987
987   986  H     28.609585    7.541492   14.178927     2   985
988   987  H     27.113326    7.765840   14.231585     2   985
989   988  O     -2.744580  -20.033964  -20.159043     1   989   990
990   989  H     -1.813428  -20.252248  -20.119813     2   988
991   990  H     -2.834074  -19.262740  -19.599190     2   988
992   991  O    -12.855213    4.078968  -33.671046     1   992   993
993   992  H    -12.706712    3.771516  -34.565279     2   991
994   993  H    -13.807296    4.078777  -33.572203     2   991
995   994  O    -12.403226  -19.063954  -13.814185     1   995   996
996   995  H    -12.728037  -19.892895  -14.165734     2   994
997   996  H    -13.129249  -18.724223  -13.291017     2   994
998   997  O     -0.418383   -2.310421   -6.756166     1   998   999
999   998  H      0.525770   -2.458947   -6.808564     2   997
1000   999  H     -0.806565   -3.094180   -7.145100     2   997
1001  1000  O     -6.888937  -17.831726  -15.550076     1  1001  1002
1002  1001  H     -6.378713  -18.038591  -14.767061     2  1000
1003  1002  H     -7.786776  -18.072867  -15.322112     2  1000
1004  1003  O     -5.577667  -31.680960  -11.982965     1  1004  1005
1005  1004  H     -4.890926  -31.689537  -11.316223     2  1003
1006  1005  H     -5.330413  -30.968962  -12.573012     2  1003
1007  1006  O     -6.282074  -23.585019   -3.366758     1  1007  1008
1008  1007  H     -6.456966  -23.336308   -4.274385     2  1006
1009  1008  H     -6.794854  -24.382186   -3.233297     2  1006
1010  1009  O     -8.115714   -3.468956  -21.398038     1  1010  1011
1011  1010  H     -8.972788   -3.844214  -21.195957     2  1009
1012  1011  H     -7.633645   -3.513139  -20.572273     2  1009
1013  1012  O    -33.915481   -4.471357  -11.843692     1  1013  1014
1014  1013  H    -33.395298   -3.731570  -12.157311     2  1012
1015  1014  H    -33.268071   -5.123302  -11.575252     2  1012
1016  1015  O     -3.680034   -1.064997  -23.501025     1  1016  1017
1017  1016  H     -4.322563   -1.648785  -23.097813     2  1015
1018  1017  H     -3.987211   -0.954940  -24.400892     2  1015
1019  1018  O     -1.438603   -7.220908  -24.313188     1  1019  1020
1020  1019  H     -1.462866   -6.448301  -23.748634     2  1018
1021  1020  H     -0.966678   -6.932540  -25.094444     2  1018
1022  1021  O     -3.530107  -33.923929  -11.628123     1  1022  1023
1023  1022  H     -3.464199  -33.280608  -10.922414     2  1021
1024  1023  H     -4.311162  -34.434634  -11.415133     2  1021
1025  1024  O    -17.084231   -1.721537  -17.459137     1  1025  1026
1026  1025  H    -17.746576   -1.534465  -18.124370     2  1024
1027  1026  H    -16.997009   -0.903085  -16.970505     2  1024
1028  1027  O     -4.579018  -22.184090  -19.971704     1  1028  1029
1029  1028  H     -4.307084  -22.590840  -20.794405     2  1027
1030  1029  H     -3.895373  -21.540785  -19.784567     2  1027
1031  1030  O    -18.345660  -12.354005   -7.364119     1  1031  1032
1032  1031  H    -17.528524  -12.779249   -7.103950     2  1030
1033  1032  H    -18.715158  -12.932156   -8.031536     2  1030
1034  1033  O    -10.208193  -31.096432   -6.506510     1  1034  1035
1035  1034  H    -10.535122  -31.995171   -6.546720     2  1033
1036  1035  H    -10.859947  -30.627044   -5.985815     2  1033
1037  1036  O     33.874639    1.433259   -3.704836     1  1037  1038
1038  1037  H     34.590108    0.798401   -3.740767     2  1036
1039  1038  H     34.308743    2.285904   -3.732789     2  1036
1040  1039  O     -8.133989   -2.462237  -30.596343     1  1040  1041
1041  1040  H     -7.716045   -2.825505  -31.377106     2  1039
1042  1041  H     -7.469382   -1.890229  -30.212498     2  1039
1043  1042  O     10.498114   17.549694   23.573041     1  1043  1044
1044  1043  H     11.024941   18.334555   23.422450     2  1042
1045  1044  H     10.999846   16.842455   23.167689     2  1042
1046  1045  O    -18.871205  -23.257178   -2.485157     1  1046  1047
1047  1046  H    -18.430779  -22.409177   -2.541293     2  1045
1048  1047  H    -19.139074  -23.328295   -1.568958     2  1045
1049  1048  O     -7.491722  -15.099511  -23.326892     1  1049  1050
1050  1049  H     -7.401984  -15.607604  -24.133130     2  1048
1051  1050  H     -7.181342  -14.224282  -23.558993     2  1048
1052  1051  O    -29.621176   -3.840213  -11.718610     1  1052  1053
1053  1052  H    -29.726502   -4.440730  -10.980696     2  1051
1054  1053  H    -29.660303   -4.401961  -12.492651     2  1051
1055  1054  O     -9.006689   -0.609784  -34.110308     1  1055  1056
1056  1055  H     -9.504309   -1.416485  -34.243877     2  1054
1057  1056  H     -8.274926   -0.674819  -34.723925     2  1054
1058  1057  O     -0.016377  -23.995459  -20.103162     1  1058  1059
1059  1058  H     -0.757345  -24.533541  -20.381847     2  1057
1060  1059  H      0.747820  -24.417634  -20.495594     2  1057
1061  1060  O    -14.919402  -17.846097   -0.583618     1  1061  1062
1062  1061  H    -15.602871  -18.153397    0.011922     2  1060
1063  1062  H    -14.963126  -16.891575   -0.526991     2  1060
1064  1063  O     -2.422425    5.482057   -0.978978     1  1064  1065
1065  1064  H     -3.148158    5.264766   -0.393891     2  1063
1066  1065  H     -2.182744    4.648484   -1.383875     2  1063
1067  1066  O    -13.194645  -34.527600   -5.630674     1  1067  1068
1068  1067  H    -13.688399  -33.943404   -6.206133     2  1066
1069  1068  H    -13.864216  -35.036723   -5.173836     2  1066
1070  1069  O    -15.889138  -18.688434   -6.640641     1  1070  1071
1071  1070  H    -15.285639  -19.357219   -6.316995     2  1069
1072  1071  H    -16.621183  -18.707224   -6.024208     2  1069
1073  1072  O    -15.498215  -18.255512  -15.621818     1  1073  1074
1074  1073  H    -15.543561  -18.994677  -15.015343     2  1072
1075  1074  H    -16.295964  -17.755092  -15.450331     2  1072
1076  1075  O      2.584721  -20.178359  -20.185052     1  1076  1077
1077  1076  H      3.018310  -20.492842  -20.978357     2  1075
1078  1077  H      2.198742  -19.339987  -20.438793     2  1075
1079  1078  O     -5.945088  -14.081973  -19.561519     1  1079  1080
1080  1079  H     -6.302795  -13.760485  -18.733918     2  1078
1081  1080  H     -6.702962  -14.429661  -20.031595     2  1078
1082  1081  O    -12.979088   -0.511993   -4.174414     1  1082  1083
1083  1082  H    -12.221702   -0.956074   -3.793112     2  1081
1084  1083  H    -12.702423   -0.285171   -5.062242     2  1081
1085  1084  O     -9.575230  -22.289198   -3.257971     1  1085  1086
1086  1085  H     -9.532879  -22.971117   -2.587579     2  1084
1087  1086  H     -9.043706  -22.627665   -3.978494     2  1084
1088  1087  O     -8.836484   -8.722528  -19.309103     1  1088  1089
1089  1088  H     -9.294532   -8.242804  -19.999241     2  1087
1090  1089  H     -8.338645   -8.052372  -18.840831     2  1087
1091  1090  O    -28.654900    3.478103    3.105712     1  1091  1092
1092  1091  H    -28.068444    4.220413    2.959846     2  1090
1093  1092  H    -28.109941    2.824099    3.543353     2  1090
1094  1093  O    -13.129778  -21.652810  -14.626085     1  1094  1095
1095  1094  H    -13.683682  -22.432745  -14.659585     2  1093
1096  1095  H    -12.428153  -21.882732  -14.016913     2  1093
1097  1096  O     29.922707   11.937786   10.977062     1  1097  1098
1098  1097  H     29.802955   11.647226   10.072924     2  1096
1099  1098  H     29.443291   12.764650   11.028906     2  1096
1100  1099  O    -17.662264   -1.613622  -22.053215     1  1100  1101
1101  1100  H    -16.724512   -1.424700  -22.087279     2  1099
1102  1101  H    -17.724757   -2.551743  -22.232811     2  1099
1103  1102  O     -8.014737  -24.407656    3.766417     1  1103  1104
1104  1103  H     -8.409178  -24.994267    3.121020     2  1102
1105  1104  H     -8.516279  -24.560004    4.567340     2  1102
1106  1105  O     -9.543096  -26.844863   -0.800273     1  1106  1107
1107  1106  H     -8.855308  -27.197360   -1.365008     2  1105
1108  1107  H    -10.349404  -26.961346   -1.302797     2  1105
1109  1108  O      1.416934  -23.879575   -4.425236     1  1109  1110
1110  1109  H      2.263614  -24.253349   -4.180989     2  1108
1111  1110  H      1.220640  -23.253949   -3.727890     2  1108
1112  1111  O     -6.634973   -4.567135  -36.276268     1  1112  1113
1113  1112  H     -7.228249   -5.315617  -36.212781     2  1111
1114  1113  H     -7.026402   -4.006802  -36.946374     2  1111
1115  1114  O     -9.132375  -11.437452  -22.477483     1  1115  1116
1116  1115  H     -9.796044  -11.684160  -23.121618     2  1114
1117  1116  H     -8.312335  -11.777350  -22.835582     2  1114
1118  1117  O     12.143206    4.304200  -34.544516     1  1118  1119
1119  1118  H     12.052402    3.756383  -35.324184     2  1117
1120  1119  H     13.078801    4.282330  -34.343480     2  1117
1121  1120  O    -16.545774  -27.265365   -3.931543     1  1121  1122
1122  1121  H    -16.636048  -28.175926   -4.212541     2  1120
1123  1122  H    -17.144502  -26.778864   -4.498175     2  1120
1124  1123  O     24.619809   16.854830    7.580967     1  1124  1125
1125  1124  H     24.691823   17.629684    7.023610     2  1123
1126  1125  H     24.774368   17.181551    8.467306     2  1123
1127  1126  O    -15.509693   -2.744408  -15.388526     1  1127  1128
1128  1127  H    -15.904755   -3.445709  -14.870516     2  1126
1129  1128  H    -16.149044   -2.566126  -16.078221     2  1126
1130  1129  O     33.393518    3.440535   14.893549     1  1130  1131
1131  1130  H     33.541846    2.798212   15.587559     2  1129
1132  1131  H     33.904720    4.204536   15.160396     2  1129
1133  1132  O    -15.625251  -13.224562   -3.274333     1  1133  1134
1134  1133  H    -15.478060  -12.293636   -3.441494     2  1132
1135  1134  H    -16.460881  -13.255554   -2.808507     2  1132
1136  1135  O      2.733185   -7.868785  -21.959301     1  1136  1137
1137  1136  H      1.853831   -8.069836  -22.279530     2  1135
1138  1137  H      3.312660   -8.109272  -22.682216     2  1135
1139  1138  O    -14.605992    3.670637  -17.273623     1  1139  1140
1140  1139  H    -13.775328    3.413665  -16.873379     2  1138
1141  1140  H    -14.456662    3.581259  -18.214868     2  1138
1142  1141  O     -5.611837  -11.625944  -28.509002     1  1142  1143
1143  1142  H     -5.492665  -11.706964  -29.455292     2  1141
1144  1143  H     -6.560819  -11.639591  -28.384589     2  1141
1145  1144  O     -4.506319  -27.897723  -15.766077     1  1145  1146
1146  1145  H     -4.085381  -27.068131  -15.540647     2  1144
1147  1146  H     -5.317727  -27.643473  -16.205628     2  1144
1148  1147  O      1.927613   -7.255240  -16.483136     1  1148  1149
1149  1148  H      2.440002   -7.644690  -15.774604     2  1147
1150  1149  H      1.096857   -7.730466  -16.467784     2  1147
1151  1150  O     -8.072496  -19.051100  -10.076031     1  1151  1152
1152  1151  H     -8.507887  -18.285369  -10.450627     2  1150
1153  1152  H     -7.519959  -19.383090  -10.783644     2  1150
1154  1153  O     -5.250226  -14.856019   -5.059162     1  1154  1155
1155  1154  H     -4.957751  -14.012823   -5.405153     2  1153
1156  1155  H     -5.953079  -15.126999   -5.649755     2  1153
1157  1156  O     33.681389    9.945814   10.883444     1  1157  1158
1158  1157  H     33.688720    9.294812   10.181750     2  1156
1159  1158  H     34.018249    9.478502   11.647889     2  1156
1160  1159  O     22.885193    3.632304   25.986516     1  1160  1161
1161  1160  H     23.840930    3.676068   26.016207     2  1159
1162  1161  H     22.614843    3.664803   26.904169     2  1159
1163  1162  O    -23.657684  -21.362372   -8.608534     1  1163  1164
1164  1163  H    -22.827395  -21.521055   -9.057612     2  1162
1165  1164  H    -23.445874  -20.718092   -7.933055     2  1162
1166  1165  O     -1.525751  -16.615202  -22.601106     1  1166  1167
1167  1166  H     -2.471705  -16.519228  -22.490685     2  1165
1168  1167  H     -1.152723  -16.260525  -21.794084     2  1165
1169  1168  O     -6.227205   -3.937581  -33.137928     1  1169  1170
1170  1169  H     -6.777932   -4.387663  -33.778520     2  1168
1171  1170  H     -5.719016   -3.312772  -33.655219     2  1168
1172  1171  O     -0.327393  -21.401613   -7.613493     1  1172  1173
1173  1172  H     -0.214287  -21.231923   -8.548717     2  1171
1174  1173  H     -0.014525  -22.298136   -7.492697     2  1171
1175  1174  O      1.567495  -25.092778  -22.206960     1  1175  1176
1176  1175  H      1.138941  -25.638247  -22.866533     2  1174
1177  1176  H      2.502055  -25.177666  -22.395703     2  1174
1178  1177  O     -9.058520   35.952284    0.546308     1  1178  1179
1179  1178  H     -8.944845   36.383509   -0.300660     2  1177
1180  1179  H     -8.167328   35.770618    0.844647     2  1177
1181  1180  O    -33.926478   -8.333429   -9.667614     1  1181  1182
1182  1181  H    -34.810810   -8.158206   -9.345925     2  1180
1183  1182  H    -33.956018   -8.093271  -10.593726     2  1180
1184  1183  O     17.354027   21.884681    9.612115     1  1184  1185
1185  1184  H     17.028458   21.594109   10.464057     2  1183
1186  1185  H     16.594065   21.828427    9.032871     2  1183
1187  1186  O      1.776831  -17.100673  -13.588182     1  1187  1188
1188  1187  H      1.299615  -17.929915  -13.558964     2  1186
1189  1188  H      1.195216  -16.505614  -14.061322     2  1186
1190  1189  O    -13.705315   -6.608579  -29.655631     1  1190  1191
1191  1190  H    -13.133298   -6.708627  -30.416564     2  1189
1192  1191  H    -14.590730   -6.702487  -30.006990     2  1189
1193  1192  O     -9.223907  -11.758589  -12.300795     1  1193  1194
1194  1193  H     -9.761013  -10.978320  -12.438379     2  1192
1195  1194  H     -8.980169  -11.722124  -11.375866     2  1192
1196  1195  O     -9.981762  -23.819546   -6.870026     1  1196  1197
1197  1196  H    -10.912843  -23.630826   -6.987096     2  1195
1198  1197  H     -9.618591  -23.015155   -6.499495     2  1195
1199  1198  O    -13.851401  -29.750775   -0.749553     1  1199  1200
1200  1199  H    -14.741662  -29.471507   -0.535832     2  1198
1201  1200  H    -13.897659  -30.018366   -1.667423     2  1198
1202  1201  O    -19.767219   -3.164236  -19.603960     1  1202  1203
1203  1202  H    -19.630510   -2.293340  -19.231022     2  1201
1204  1203  H    -20.717595   -3.278326  -19.605114     2  1201
1205  1204  O     18.212326   24.375477    1.111443     1  1205  1206
1206  1205  H     18.407069   24.530347    2.035739     2  1204
1207  1206  H     17.644781   25.104238    0.860383     2  1204
1208  1207  O     -2.015252  -21.826193  -24.332077     1  1208  1209
1209  1208  H     -2.277878  -21.228727  -25.032287     2  1207
1210  1209  H     -1.189229  -21.467438  -24.007712     2  1207
1211  1210  O     24.331079   19.516329    4.915608     1  1211  1212
1212  1211  H     24.661038   18.783198    4.396112     2  1210
1213  1212  H     24.083459   20.176759    4.268501     2  1210
1214  1213  O      1.124328  -32.973889   -3.206419     1  1214  1215
1215  1214  H      0.619194  -32.313535   -3.680763     2  1213
1216  1215  H      0.472784  -33.451036   -2.692558     2  1213
1217  1216  O    -12.777016  -22.959293   -7.112098     1  1217  1218
1218  1217  H    -13.172106  -22.510441   -7.859539     2  1216
1219  1218  H    -13.452778  -22.937587   -6.434525     2  1216
1220  1219  O     22.270521    7.326789   17.118584     1  1220  1221
1221  1220  H     22.023614    6.415787   16.959386     2  1219
1222  1221  H     22.440997    7.368305   18.059566     2  1219
1223  1222  O    -15.169517  -17.018522  -21.129659     1  1223  1224
1224  1223  H    -15.985173  -17.471539  -21.343464     2  1222
1225  1224  H    -14.976981  -17.282702  -20.230008     2  1222
1226  1225  O     -8.741547   -6.857269  -25.415058     1  1226  1227
1227  1226  H     -9.267795   -6.539880  -24.681192     2  1225
1228  1227  H     -8.597686   -6.083336  -25.959636     2  1225
1229  1228  O      0.791381  -28.836126   -7.125672     1  1229  1230
1230  1229  H      0.138437  -28.519859   -6.501275     2  1228
1231  1230  H      0.396725  -28.682498   -7.984087     2  1228
1232  1231  O      2.709852  -24.929405   -9.403762     1  1232  1233
1233  1232  H      2.735148  -24.240443   -8.739742     2  1231
1234  1233  H      3.408909  -24.698791  -10.015617     2  1231
1235  1234  O     -1.382904   32.642202    5.357093     1  1235  1236
1236  1235  H     -0.793977   32.779703    4.615142     2  1234
1237  1236  H     -0.809024   32.647294    6.123166     2  1234
1238  1237  O     -8.084228  -20.988794  -14.301056     1  1238  1239
1239  1238  H     -7.130751  -20.905246  -14.289466     2  1237
1240  1239  H     -8.269855  -21.511666  -15.081043     2  1237
1241  1240  O    -28.702517  -10.112034    0.338183     1  1241  1242
1242  1241  H    -29.237516   -9.705797   -0.343711     2  1240
1243  1242  H    -28.049992   -9.447451    0.559029     2  1240
1244  1243  O      0.858333  -18.491190  -30.012336     1  1244  1245
1245  1244  H      0.071510  -18.609094  -30.544539     2  1243
1246  1245  H      1.581764  -18.556931  -30.635679     2  1243
1247  1246  O     -7.071595   -2.061943  -27.515203     1  1247  1248
1248  1247  H     -6.947185   -2.814872  -28.093002     2  1246
1249  1248  H     -7.978171   -1.792902  -27.663420     2  1246
1250  1249  O     -8.794205  -20.521484   -1.262705     1  1250  1251
1251  1250  H     -9.125875  -20.747827   -2.131610     2  1249
1252  1251  H     -7.842803  -20.588060   -1.344148     2  1249
1253  1252  O     -4.180744  -21.392787  -10.052811     1  1253  1254
1254  1253  H     -3.603582  -20.776844  -10.504174     2  1252
1255  1254  H     -5.064161  -21.117353  -10.297642     2  1252
1256  1255  O    -11.167454  -25.271298   -3.809687     1  1256  1257
1257  1256  H    -11.997947  -24.824225   -3.646474     2  1255
1258  1257  H    -11.151482  -25.987296   -3.174610     2  1255
1259  1258  O    -16.818337    1.434317   -8.929457     1  1259  1260
1260  1259  H    -17.066781    1.162884   -8.045810     2  1258
1261  1260  H    -15.941718    1.805362   -8.828977     2  1258
1262  1261  O    -12.807260  -17.451794   -4.712176     1  1262  1263
1263  1262  H    -13.457370  -16.805426   -4.436864     2  1261
1264  1263  H    -12.484372  -17.830667   -3.894600     2  1261
1265  1264  O     -0.771106    0.008694  -19.118642     1  1265  1266
1266  1265  H     -1.030939   -0.451974  -19.916454     2  1264
1267  1266  H      0.159297   -0.192279  -19.017680     2  1264
1268  1267  O    -32.587032  -11.792063   -6.644499     1  1268  1269
1269  1268  H    -32.899331  -12.219180   -5.846832     2  1267
1270  1269  H    -31.857404  -12.337295   -6.938773     2  1267
1271  1270  O      3.433803  -26.252900  -13.331467     1  1271  1272
1272  1271  H      4.140836  -25.813864  -12.858622     2  1270
1273  1272  H      3.284421  -27.062139  -12.842541     2  1270
1274  1273  O     31.713890   14.922110    5.407696     1  1274  1275
1275  1274  H     31.966105   15.759410    5.796989     2  1273
1276  1275  H     32.533396   14.555031    5.076193     2  1273
1277  1276  O    -13.501760  -18.328764  -19.191488     1  1277  1278
1278  1277  H    -13.533817  -18.789323  -18.352984     2  1276
1279  1278  H    -12.569287  -18.276974  -19.401351     2  1276
1280  1279  O     29.946218   18.444479    1.615584     1  1280  1281
1281  1280  H     30.295647   17.655474    2.029832     2  1279
1282  1281  H     30.721026   18.931131    1.334386     2  1279
1283  1282  O    -21.285788  -17.572862   -0.764795     1  1283  1284
1284  1283  H    -21.377693  -18.371575   -1.284258     2  1282
1285  1284  H    -21.603364  -16.875572   -1.338522     2  1282
1286  1285  O    -14.010773  -10.203653  -13.279913     1  1286  1287
1287  1286  H    -14.703038  -10.513337  -13.863948     2  1285
1288  1287  H    -13.791761  -10.964896  -12.742537     2  1285
1289  1288  O    -12.691348  -25.177676   -0.657606     1  1289  1290
1290  1289  H    -12.465060  -26.000750   -0.224507     2  1288
1291  1290  H    -12.229992  -24.506862   -0.154226     2  1288
1292  1291  O     -5.031335  -10.287073  -22.512319     1  1292  1293
1293  1292  H     -5.646157   -9.861633  -23.110003     2  1291
1294  1293  H     -4.170885  -10.129526  -22.900954     2  1291
1295  1294  O     -1.597828  -22.671213  -14.980106     1  1295  1296
1296  1295  H     -1.334407  -23.375393  -14.387678     2  1294
1297  1296  H     -1.273649  -22.945451  -15.837971     2  1294
1298  1297  O     18.802743   15.673727   15.163450     1  1298  1299
1299  1298  H     19.696374   15.808086   15.479049     2  1297
1300  1299  H     18.791949   14.768902   14.851349     2  1297
1301  1300  O    -10.492850  -11.768564  -20.055434     1  1301  1302
1302  1301  H    -10.245956  -11.195287  -20.781126     2  1300
1303  1302  H     -9.668945  -11.953427  -19.604615     2  1300
1304  1303  O    -19.112784  -13.538358  -14.110167     1  1304  1305
1305  1304  H    -19.607629  -13.238040  -13.347822     2  1303
1306  1305  H    -19.005810  -12.755495  -14.650458     2  1303
1307  1306  O      1.681717  -17.721724  -17.957860     1  1307  1308
1308  1307  H      1.768048  -16.822035  -17.642680     2  1306
1309  1308  H      2.348469  -17.802090  -18.639926     2  1306
1310  1309  O     10.409060   33.872204    9.668149     1  1310  1311
1311  1310  H     10.045986   34.682076    9.309656     2  1309
1312  1311  H     11.136536   33.656416    9.084672     2  1309
1313  1312  O    -31.990681   10.289144    8.099180     1  1313  1314
1314  1313  H    -32.716715   10.680661    7.613566     2  1312
1315  1314  H    -31.827727    9.456031    7.656913     2  1312
1316  1315  O     -4.864645  -19.579605   -6.647948     1  1316  1317
1317  1316  H     -4.407176  -20.323646   -7.039555     2  1315
1318  1317  H     -4.270370  -18.839704   -6.772915     2  1315
1319  1318  O    -19.139712    0.573843  -16.256377     1  1319  1320
1320  1319  H    -18.764040   -0.043165  -15.628363     2  1318
1321  1320  H    -18.871010    1.435140  -15.936691     2  1318
1322  1321  O     -5.969820   -6.188961  -26.754163     1  1322  1323
1323  1322  H     -5.873223   -7.099901  -27.031811     2  1321
1324  1323  H     -5.896829   -6.219793  -25.800249     2  1321
1325  1324  O      0.229378  -30.326523  -12.325135     1  1325  1326
1326  1325  H     -0.482581  -30.367805  -12.963603     2  1324
1327  1326  H     -0.164374  -30.628830  -11.506721     2  1324
1328  1327  O     -1.135443  -11.768539   36.079905     1  1328  1329
1329  1328  H     -0.601322  -11.111353   36.526057     2  1327
1330  1329  H     -0.518261  -12.239667   35.520124     2  1327
1331  1330  O    -18.493321   -3.720916   -6.615855     1  1331  1332
1332  1331  H    -18.141095   -2.954759   -6.162897     2  1330
1333  1332  H    -17.808107   -4.384234   -6.533863     2  1330
1334  1333  O    -16.039292  -14.218485  -17.619233     1  1334  1335
1335  1334  H    -16.994245  -14.168403  -17.576937     2  1333
1336  1335  H    -15.759232  -14.237980  -16.704127     2  1333
1337  1336  O     27.083386    4.721289   21.284748     1  1337  1338
1338  1337  H     27.329842    5.143569   20.461844     2  1336
1339  1338  H     26.916821    5.446913   21.886376     2  1336
1340  1339  O     31.221110   12.026430    4.745853     1  1340  1341
1341  1340  H     30.710586   11.391667    5.248519     2  1339
1342  1341  H     31.135757   12.844578    5.235323     2  1339
1343  1342  O    -14.413541   -8.807440    1.666061     1  1343  1344
1344  1343  H    -13.856591   -9.577262    1.550254     2  1342
1345  1344  H    -13.800505   -8.088845    1.821108     2  1342
1346  1345  O     -7.766412  -15.670208  -20.697978     1  1346  1347
1347  1346  H     -8.694714  -15.903129  -20.682632     2  1345
1348  1347  H     -7.556100  -15.583421  -21.627746     2  1345
1349  1348  O    -14.477553   -3.167038  -30.544502     1  1349  1350
1350  1349  H    -13.592515   -3.520915  -30.632316     2  1348
1351  1350  H    -14.484681   -2.395239  -31.110635     2  1348
1352  1351  O    -15.475803   35.959618    1.708408     1  1352  1353
1353  1352  H    -15.083750   36.286012    2.518343     2  1351
1354  1353  H    -15.374576   35.009121    1.758826     2  1351
1355  1354  O     -1.392187  -35.819517    1.102863     1  1355  1356
1356  1355  H     -1.664903  -36.251367    1.912408     2  1354
1357  1356  H     -1.066513  -34.964720    1.384805     2  1354
1358  1357  O    -21.692059   -4.477972  -27.640094     1  1358  1359
1359  1358  H    -21.422141   -4.695362  -28.532348     2  1357
1360  1359  H    -21.059022   -4.928795  -27.081297     2  1357
1361  1360  O     -3.835040  -13.639706  -14.024947     1  1361  1362
1362  1361  H     -3.187523  -13.153596  -14.535487     2  1360
1363  1362  H     -4.365252  -14.093814  -14.679847     2  1360
1364  1363  O     -6.162311  -19.594480   -3.916794     1  1364  1365
1365  1364  H     -5.720230  -19.477544   -4.757699     2  1363
1366  1365  H     -7.059024  -19.298758   -4.073914     2  1363
1367  1366  O     -2.288155   -9.605597  -31.117500     1  1367  1368
1368  1367  H     -3.195412   -9.910598  -31.126958     2  1366
1369  1368  H     -2.283835   -8.847175  -31.701461     2  1366
1370  1369  O     15.132488   33.390767    3.579309     1  1370  1371
1371  1370  H     14.590993   33.879575    2.959567     2  1369
1372  1371  H     14.534791   33.160575    4.290648     2  1369
1373  1372  O     -6.936080  -22.867649   -5.748916     1  1373  1374
1374  1373  H     -6.450826  -22.838055   -6.573467     2  1372
1375  1374  H     -7.818376  -22.576446   -5.979105     2  1372
1376  1375  O     -5.169114  -25.852260   -6.355570     1  1376  1377
1377  1376  H     -5.798416  -25.570755   -5.691517     2  1375
1378  1377  H     -5.437398  -25.392042   -7.150840     2  1375
1379  1378  O    -32.064299   11.561857   10.593932     1  1379  1380
1380  1379  H    -32.135643   11.399611    9.653284     2  1378
1381  1380  H    -32.668725   10.935426   10.992033     2  1378
1382  1381  O     -2.370555  -23.562546  -10.186028     1  1382  1383
1383  1382  H     -2.609477  -24.161177   -9.478364     2  1381
1384  1383  H     -2.965064  -22.819490  -10.082788     2  1381
1385  1384  O     -7.175783   -4.187564  -11.298056     1  1385  1386
1386  1385  H     -7.807641   -4.902724  -11.372446     2  1384
1387  1386  H     -6.400039   -4.503553  -11.761310     2  1384
1388  1387  O    -13.804043  -20.214298   -5.510243     1  1388  1389
1389  1388  H    -13.357731  -19.393136   -5.716952     2  1387
1390  1389  H    -13.103044  -20.806516   -5.238011     2  1387
1391  1390  O     -8.357390   -6.006409  -14.398043     1  1391  1392
1392  1391  H     -7.483587   -6.387522  -14.484378     2  1390
1393  1392  H     -8.198204   -5.083573  -14.199888     2  1390
1394  1393  O     -9.551448  -11.564666   -0.822351     1  1394  1395
1395  1394  H     -9.853278  -12.272926   -0.253583     2  1393
1396  1395  H     -9.064415  -10.980864   -0.240796     2  1393
1397  1396  O    -15.181436   -7.268087  -12.010154     1  1397  1398
1398  1397  H    -14.959618   -7.932294  -12.662732     2  1396
1399  1398  H    -15.716875   -6.633334  -12.486206     2  1396
1400  1399  O    -35.884921   -5.302100   -3.191539     1  1400  1401
1401  1400  H    -35.211099   -5.173370   -3.859088     2  1399
1402  1401  H    -35.936046   -4.461319   -2.736890     2  1399
1403  1402  O    -10.065789  -18.172540  -18.724846     1  1403  1404
1404  1403  H    -10.165874  -19.023892  -18.298919     2  1402
1405  1404  H     -9.189477  -18.197983  -19.109115     2  1402
1406  1405  O     32.602565   -1.072682   -5.264490     1  1406  1407
1407  1406  H     32.678026   -1.921720   -5.700002     2  1405
1408  1407  H     31.672003   -0.992190   -5.055188     2  1405
1409  1408  O    -18.958913   -8.753699  -23.794593     1  1409  1410
1410  1409  H    -19.504091   -8.734372  -23.008057     2  1408
1411  1410  H    -18.514654   -9.600764  -23.757907     2  1408
1412  1411  O    -13.234930   -5.889432   -6.370463     1  1412  1413
1413  1412  H    -13.819844   -5.148116   -6.527169     2  1411
1414  1413  H    -12.584214   -5.833808   -7.070254     2  1411
1415  1414  O     -3.652378  -31.760978   -9.692949     1  1415  1416
1416  1415  H     -4.189561  -32.041982   -8.952204     2  1414
1417  1416  H     -3.651999  -30.805232   -9.640224     2  1414
1418  1417  O     -6.718794  -20.743539  -23.369662     1  1418  1419
1419  1418  H     -7.386149  -20.389056  -22.782116     2  1417
1420  1419  H     -5.888074  -20.539956  -22.939905     2  1417
1421  1420  O    -16.857255   -5.126387  -12.629824     1  1421  1422
1422  1421  H    -17.621939   -5.594997  -12.295319     2  1420
1423  1422  H    -17.207724   -4.547556  -13.306845     2  1420
1424  1423  O     -4.303784   -2.375495   31.482584     1  1424  1425
1425  1424  H     -4.972843   -2.176642   32.137602     2  1423
1426  1425  H     -4.073519   -3.290314   31.644809     2  1423
1427  1426  O    -19.511095  -18.995055  -15.714587     1  1427  1428
1428  1427  H    -19.343410  -19.818873  -15.256944     2  1426
1429  1428  H    -18.728094  -18.852221  -16.246320     2  1426
1430  1429  O    -34.070752   11.340454    6.418919     1  1430  1431
1431  1430  H    -34.517940   10.842451    5.734633     2  1429
1432  1431  H    -34.632433   12.101027    6.568163     2  1429
1433  1432  O    -17.673542  -20.965837   -2.180224     1  1433  1434
1434  1433  H    -18.221260  -20.222314   -1.928408     2  1432
1435  1434  H    -17.018595  -20.592551   -2.770083     2  1432
1436  1435  O    -34.237049  -11.285151   -2.214164     1  1436  1437
1437  1436  H    -35.164801  -11.348450   -2.441100     2  1435
1438  1437  H    -33.794498  -11.840122   -2.856338     2  1435
1439  1438  O    -10.911886   -4.651657  -20.963069     1  1439  1440
1440  1439  H    -10.584042   -5.253813  -21.631020     2  1438
1441  1440  H    -10.725634   -5.089864  -20.132698     2  1438
1442  1441  O    -12.751989   -3.589577   34.947650     1  1442  1443
1443  1442  H    -12.938097   -4.031441   34.119186     2  1441
1444  1443  H    -12.139541   -2.891674   34.715120     2  1441
1445  1444  O     -4.680813   -0.821924  -11.971687     1  1445  1446
1446  1445  H     -4.580518    0.038750  -12.378394     2  1444
1447  1446  H     -5.353629   -1.257641  -12.494850     2  1444
1448  1447  O     25.398435   26.912023    0.861452     1  1448  1449
1449  1448  H     26.122669   27.230593    0.322721     2  1447
1450  1449  H     24.613410   27.116126    0.353211     2  1447
1451  1450  O     29.978845    3.853573   15.857236     1  1451  1452
1452  1451  H     30.386890    3.402622   16.596407     2  1450
1453  1452  H     29.630718    3.150047   15.309432     2  1450
1454  1453  O     -9.201298  -16.695615   -6.922522     1  1454  1455
1455  1454  H     -8.479395  -17.174544   -7.329603     2  1453
1456  1455  H     -8.879377  -15.797614   -6.843831     2  1453
1457  1456  O    -27.720618   -7.595378    1.222673     1  1457  1458
1458  1457  H    -28.465454   -6.995100    1.256114     2  1456
1459  1458  H    -26.980215   -7.045124    0.967220     2  1456
1460  1459  O     18.693304   18.492757   13.829766     1  1460  1461
1461  1460  H     18.384351   18.262925   12.953435     2  1459
1462  1461  H     18.689574   17.664939   14.310324     2  1459
1463  1462  O    -23.246441   -1.044989  -16.910925     1  1463  1464
1464  1463  H    -22.720358   -0.963405  -17.706420     2  1462
1465  1464  H    -22.705261   -0.655267  -16.224287     2  1462
1466  1465  O     36.322943   -3.010871   -8.206082     1  1466  1467
1467  1466  H     37.005735   -3.680684   -8.168968     2  1465
1468  1467  H     35.876490   -3.076246   -7.361904     2  1465
1469  1468  O    -10.247562   -3.810291  -24.855292     1  1469  1470
1470  1469  H     -9.984211   -3.917324  -25.769306     2  1468
1471  1470  H     -9.610274   -3.195156  -24.492380     2  1468
1472  1471  O     17.076235   19.897830   11.720468     1  1472  1473
1473  1472  H     17.186870   20.383965   12.537576     2  1471
1474  1473  H     16.217727   19.482567   11.802635     2  1471
1475  1474  O     -8.819127  -18.140802   -4.392911     1  1475  1476
1476  1475  H     -9.015388  -17.780338   -5.257654     2  1474
1477  1476  H     -9.375526  -17.643318   -3.793611     2  1474
1478  1477  O      3.408447  -28.453952   -9.496343     1  1478  1479
1479  1478  H      4.218832  -28.167084   -9.075374     2  1477
1480  1479  H      2.720706  -27.949523   -9.061837     2  1477
1481  1480  O     21.643216   23.433054   -1.772357     1  1481  1482
1482  1481  H     22.086939   24.274135   -1.881558     2  1480
1483  1482  H     22.293214   22.871932   -1.349419     2  1480
1484  1483  O    -11.591264   -6.964825   -8.893755     1  1484  1485
1485  1484  H    -11.195135   -7.660438   -9.418575     2  1483
1486  1485  H    -10.912321   -6.723288   -8.263733     2  1483
1487  1486  O    -12.804546  -16.091514  -22.137179     1  1487  1488
1488  1487  H    -13.059968  -15.241331  -21.779158     2  1486
1489  1488  H    -13.564906  -16.653295  -21.987222     2  1486
1490  1489  O     -2.899391   -4.881181  -32.329705     1  1490  1491
1491  1490  H     -2.086613   -5.386051  -32.356714     2  1489
1492  1491  H     -3.229157   -4.909012  -33.227876     2  1489
1493  1492  O    -12.689766  -11.849114  -17.680877     1  1493  1494
1494  1493  H    -12.059289  -11.941116  -18.395206     2  1492
1495  1494  H    -12.612069  -12.664580  -17.185690     2  1492
1496  1495  O     -9.821096   -1.047925  -27.878810     1  1496  1497
1497  1496  H    -10.347387   -0.998087  -28.676785     2  1495
1498  1497  H    -10.462618   -1.058240  -27.168475     2  1495
1499  1498  O    -20.340544   -7.094761   -4.580645     1  1499  1500
1500  1499  H    -20.650875   -7.986286   -4.422185     2  1498
1501  1500  H    -21.032828   -6.688851   -5.102383     2  1498
1502  1501  O     -4.203791   -4.924531   -7.969333     1  1502  1503
1503  1502  H     -4.825019   -5.646003   -8.068253     2  1501
1504  1503  H     -4.751030   -4.140093   -7.931663     2  1501
1505  1504  O      2.188215  -30.638773    0.402661     1  1505  1506
1506  1505  H      2.840592  -31.129290    0.902691     2  1504
1507  1506  H      2.687908  -30.220772   -0.298633     2  1504
1508  1507  O    -31.125169  -10.387453   -3.621878     1  1508  1509
1509  1508  H    -31.649171  -11.177991   -3.492636     2  1507
1510  1509  H    -31.374824  -10.073475   -4.490970     2  1507
1511  1510  O     -2.018097  -10.141671  -17.811241     1  1511  1512
1512  1511  H     -2.941766  -10.301071  -17.617187     2  1510
1513  1512  H     -1.840809  -10.672899  -18.587513     2  1510
1514  1513  O     10.586107   25.284554   11.471296     1  1514  1515
1515  1514  H     11.396462   25.789865   11.406365     2  1513
1516  1515  H     10.688950   24.582472   10.828850     2  1513
1517  1516  O    -26.163275  -10.834807   -9.675353     1  1517  1518
1518  1517  H    -25.478007  -10.197995   -9.472596     2  1516
1519  1518  H    -26.355182  -10.693840  -10.602462     2  1516
1520  1519  O    -17.379755    3.238496  -18.122697     1  1520  1521
1521  1520  H    -16.473494    3.283305  -17.817877     2  1519
1522  1521  H    -17.904792    3.404142  -17.339672     2  1519
1523  1522  O     -9.626582   -5.529554  -10.989272     1  1523  1524
1524  1523  H    -10.393792   -5.300528  -11.513835     2  1522
1525  1524  H     -9.786384   -6.431494  -10.711422     2  1522
1526  1525  O    -22.809402  -14.291055   -6.699101     1  1526  1527
1527  1526  H    -23.581082  -13.930061   -6.262725     2  1525
1528  1527  H    -22.319616  -13.523486   -6.994363     2  1525
1529  1528  O    -21.797957   -5.182887  -17.107539     1  1529  1530
1530  1529  H    -22.314007   -5.895016  -16.729655     2  1528
1531  1530  H    -21.252698   -5.607033  -17.770128     2  1528
1532  1531  O     -4.310522   -5.659263  -23.172879     1  1532  1533
1533  1532  H     -4.138223   -6.332541  -22.514669     2  1531
1534  1533  H     -4.623846   -6.144475  -23.936180     2  1531
1535  1534  O    -20.317468  -17.349899  -13.114738     1  1535  1536
1536  1535  H    -19.731931  -17.791342  -13.729967     2  1534
1537  1536  H    -19.789743  -17.229867  -12.325225     2  1534
1538  1537  O     -9.342525  -20.942960   -6.533402     1  1538  1539
1539  1538  H    -10.163048  -20.512465   -6.773502     2  1537
1540  1539  H     -8.664977  -20.297549   -6.734906     2  1537
1541  1540  O     32.051443   -7.047251  -13.747784     1  1541  1542
1542  1541  H     31.136876   -7.262189  -13.564477     2  1540
1543  1542  H     32.411849   -6.788650  -12.899572     2  1540
1544  1543  O    -24.676146   -7.725332  -10.675540     1  1544  1545
1545  1544  H    -24.584797   -8.386156  -11.361979     2  1543
1546  1545  H    -24.199501   -8.087622   -9.928689     2  1543
1547  1546  O    -13.774315  -15.874037   -7.028029     1  1547  1548
1548  1547  H    -13.656000  -16.547431   -6.358123     2  1546
1549  1548  H    -13.435368  -15.073942   -6.626538     2  1546
1550  1549  O     -9.734557  -20.380234    1.226926     1  1550  1551
1551  1550  H     -9.255259  -20.358995    0.398641     2  1549
1552  1551  H     -9.062990  -20.545683    1.888633     2  1549
1553  1552  O     -5.688413   -8.686645  -27.457431     1  1553  1554
1554  1553  H     -5.977854   -8.376442  -28.315469     2  1552
1555  1554  H     -6.303681   -9.385274  -27.234734     2  1552
1556  1555  O    -23.417293  -20.872252    1.638064     1  1556  1557
1557  1556  H    -22.865893  -20.125705    1.872279     2  1555
1558  1557  H    -23.021438  -21.221882    0.839760     2  1555
1559  1558  O     -5.969923   -1.950034  -19.515158     1  1559  1560
1560  1559  H     -5.434194   -2.041931  -18.727261     2  1558
1561  1560  H     -5.387433   -2.201033  -20.232052     2  1558
1562  1561  O    -15.333251    2.856239  -20.241684     1  1562  1563
1563  1562  H    -16.141140    2.570199  -19.815389     2  1561
1564  1563  H    -15.338889    2.411813  -21.089438     2  1561
1565  1564  O    -28.169338  -13.887008   -3.342103     1  1565  1566
1566  1565  H    -28.298031  -13.658021   -2.421650     2  1564
1567  1566  H    -28.007647  -13.049939   -3.777307     2  1564
1568  1567  O     -1.223181   -1.944217   -9.653916     1  1568  1569
1569  1568  H     -1.675397   -2.681431   -9.243736     2  1567
1570  1569  H     -1.524698   -1.953107  -10.562344     2  1567
1571  1570  O     28.795123   11.108920    8.545882     1  1571  1572
1572  1571  H     28.441938   11.734537    7.913351     2  1570
1573  1572  H     29.685484   10.935414    8.240292     2  1570
1574  1573  O     -5.378583   -5.372481  -16.525850     1  1574  1575
1575  1574  H     -4.721149   -5.834810  -17.045719     2  1573
1576  1575  H     -5.285274   -5.734000  -15.644471     2  1573
1577  1576  O     -9.717146   -8.198442  -30.091398     1  1577  1578
1578  1577  H    -10.415244   -8.840197  -29.960849     2  1576
1579  1578  H     -9.004103   -8.501829  -29.529475     2  1576
1580  1579  O    -21.719261   -6.259951  -20.417511     1  1580  1581
1581  1580  H    -21.285724   -5.931522  -21.205173     2  1579
1582  1581  H    -21.047729   -6.213707  -19.736968     2  1579
1583  1582  O     -4.089824  -33.291115    8.181695     1  1583  1584
1584  1583  H     -4.553678  -33.616345    7.410140     2  1582
1585  1584  H     -3.196586  -33.133407    7.875940     2  1582
1586  1585  O    -22.296160   -9.527994   -2.227922     1  1586  1587
1587  1586  H    -22.651272  -10.212248   -2.795305     2  1585
1588  1587  H    -22.999106   -8.881590   -2.162647     2  1585
1589  1588  O    -12.911392  -19.585352   -0.541149     1  1589  1590
1590  1589  H    -13.551986  -18.894892   -0.370455     2  1588
1591  1590  H    -12.450096  -19.695615    0.290284     2  1588
1592  1591  O    -17.526004   -4.872921  -19.737967     1  1592  1593
1593  1592  H    -18.224330   -4.315757  -19.394250     2  1591
1594  1593  H    -17.494879   -4.669510  -20.672786     2  1591
1595  1594  O     -5.550181  -15.170416  -15.476523     1  1595  1596
1596  1595  H     -5.477928  -16.010536  -15.929524     2  1594
1597  1596  H     -6.365850  -15.234981  -14.979786     2  1594
1598  1597  O      3.533700  -17.540994  -28.964753     1  1598  1599
1599  1598  H      3.792551  -17.922944  -29.803407     2  1597
1600  1599  H      3.443910  -18.291090  -28.376939     2  1597
1601  1600  O     -7.362057  -11.238604   -6.286087     1  1601  1602
1602  1601  H     -7.546085  -10.444314   -6.787554     2  1600
1603  1602  H     -6.451630  -11.448346   -6.494326     2  1600
1604  1603  O    -19.030392   -5.311846   -2.987319     1  1604  1605
1605  1604  H    -19.786751   -5.728688   -3.400110     2  1603
1606  1605  H    -19.402642   -4.597858   -2.469744     2  1603
1607  1606  O     -7.081248    2.183682  -12.232101     1  1607  1608
1608  1607  H     -7.048966    2.862290  -11.557801     2  1606
1609  1608  H     -6.246070    2.263345  -12.692930     2  1606
1610  1609  O     -5.245778  -14.288865    2.825967     1  1610  1611
1611  1610  H     -5.142674  -14.191245    1.879357     2  1609
1612  1611  H     -4.370745  -14.516033    3.140520     2  1609
1613  1612  O      6.148515   25.954986   20.747298     1  1613  1614
1614  1613  H      5.642189   25.385809   20.167727     2  1612
1615  1614  H      5.910377   26.842694   20.479909     2  1612
1616  1615  O     -3.343346   -5.062010   31.781524     1  1616  1617
1617  1616  H     -2.719126   -5.279872   32.473707     2  1615
1618  1617  H     -2.865689   -5.223842   30.967960     2  1615
1619  1618  O    -10.421774   -9.133381  -21.866440     1  1619  1620
1620  1619  H    -10.507696   -8.624432  -22.672554     2  1618
1621  1620  H     -9.855562   -9.867298  -22.105190     2  1618
1622  1621  O    -23.852167   -5.528534  -11.735903     1  1622  1623
1623  1622  H    -23.162934   -5.052208  -11.272973     2  1621
1624  1623  H    -24.030124   -6.289915  -11.183760     2  1621
1625  1624  O     -9.103303  -11.566910   -9.207628     1  1625  1626
1626  1625  H    -10.050910  -11.432084   -9.197912     2  1624
1627  1626  H     -8.749226  -10.816509   -8.730389     2  1624
1628  1627  O      0.046292  -13.833834  -20.814766     1  1628  1629
1629  1628  H      0.846597  -13.661506  -20.318736     2  1627
1630  1629  H     -0.518155  -14.306448  -20.202992     2  1627
1631  1630  O     23.949542   14.898048   15.108032     1  1631  1632
1632  1631  H     23.792466   14.630301   14.202565     2  1630
1633  1632  H     24.686903   14.358496   15.393363     2  1630
1634  1633  O    -19.474166   -0.298019  -18.885509     1  1634  1635
1635  1634  H    -19.456028    0.163031  -18.046857     2  1633
1636  1635  H    -19.931172    0.299108  -19.477807     2  1633
1637  1636  O    -28.703774   -2.849407  -20.995276     1  1637  1638
1638  1637  H    -28.486700   -3.305028  -21.808614     2  1636
1639  1638  H    -27.977986   -2.240069  -20.860476     2  1636
1640  1639  O    -22.782798   -3.420835  -18.825049     1  1640  1641
1641  1640  H    -23.713942   -3.637390  -18.777016     2  1639
1642  1641  H    -22.373912   -3.969780  -18.155943     2  1639
1643  1642  O     15.563440   11.465660   25.913683     1  1643  1644
1644  1643  H     15.292152   11.483220   24.995900     2  1642
1645  1644  H     14.771369   11.223468   26.393472     2  1642
1646  1645  O     28.912961   19.228377    5.621105     1  1646  1647
1647  1646  H     28.814107   20.161741    5.433247     2  1645
1648  1647  H     29.683299   19.177748    6.187009     2  1645
1649  1648  O    -22.293516   -6.749761  -14.110017     1  1649  1650
1650  1649  H    -22.936179   -6.940735  -13.426831     2  1648
1651  1650  H    -21.946898   -5.887876  -13.879274     2  1648
1652  1651  O    -26.600087   -2.791690    2.020054     1  1652  1653
1653  1652  H    -27.441146   -2.974029    2.439103     2  1651
1654  1653  H    -26.827758   -2.536016    1.126170     2  1651
1655  1654  O    -11.222559  -16.669875  -24.189812     1  1655  1656
1656  1655  H    -10.712359  -15.937737  -23.843542     2  1654
1657  1656  H    -11.971760  -16.741284  -23.598348     2  1654
1658  1657  O    -15.100392   -4.627628  -18.515331     1  1658  1659
1659  1658  H    -14.807557   -4.677260  -19.425285     2  1657
1660  1659  H    -16.034144   -4.834965  -18.552068     2  1657
1661  1660  O    -30.025251  -11.229755    2.826479     1  1661  1662
1662  1661  H    -30.925062  -11.503511    2.648633     2  1660
1663  1662  H    -29.604799  -11.214062    1.966709     2  1660
1664  1663  O    -34.037887  -16.073272   -2.804632     1  1664  1665
1665  1664  H    -33.808909  -15.999490   -3.731108     2  1663
1666  1665  H    -34.337672  -16.976584   -2.702715     2  1663
1667  1666  O    -21.035006   -4.276407  -10.534613     1  1667  1668
1668  1667  H    -20.394885   -3.739702  -10.067253     2  1666
1669  1668  H    -20.986228   -3.973150  -11.441193     2  1666
1670  1669  O    -23.115687  -12.097592  -14.215365     1  1670  1671
1671  1670  H    -22.502241  -12.543640  -14.799280     2  1669
1672  1671  H    -23.341608  -12.754878  -13.557211     2  1669
1673  1672  O     -8.328657   -1.063877   -6.974905     1  1673  1674
1674  1673  H     -7.986050   -1.928869   -7.199941     2  1672
1675  1674  H     -8.030733   -0.913714   -6.077729     2  1672
1676  1675  O     -6.668039   -8.035070  -30.108307     1  1676  1677
1677  1676  H     -6.707595   -8.297312  -31.028032     2  1675
1678  1677  H     -6.296524   -7.153086  -30.126000     2  1675
1679  1678  O    -22.685023   -4.964120   -8.412572     1  1679  1680
1680  1679  H    -22.099505   -4.916412   -9.168299     2  1678
1681  1680  H    -22.415419   -4.235273   -7.853710     2  1678
1682  1681  O     -0.596803   -4.912921  -29.059850     1  1682  1683
1683  1682  H     -0.762381   -5.610834  -28.426026     2  1681
1684  1683  H     -1.407635   -4.404414  -29.074172     2  1681
1685  1684  O    -14.584676  -12.161730   -6.784902     1  1685  1686
1686  1685  H    -14.750270  -11.558881   -6.060069     2  1684
1687  1686  H    -13.712300  -12.514345   -6.609251     2  1684
1688  1687  O     22.501722   19.164103    6.909073     1  1688  1689
1689  1688  H     22.996318   19.711084    7.519334     2  1687
1690  1689  H     22.889051   19.348565    6.053397     2  1687
1691  1690  O    -11.234931   -5.789079   -4.102652     1  1691  1692
1692  1691  H    -11.305748   -6.716836   -3.877965     2  1690
1693  1692  H    -11.728792   -5.701215   -4.917890     2  1690
1694  1693  O     -4.725056  -11.240752  -18.874879     1  1694  1695
1695  1694  H     -4.092265  -11.579260  -19.508298     2  1693
1696  1695  H     -5.456673  -11.856744  -18.913916     2  1693
1697  1696  O     -8.271760  -10.986605  -28.116503     1  1697  1698
1698  1697  H     -8.711650  -11.500269  -28.793908     2  1696
1699  1698  H     -8.980861  -10.670557  -27.556573     2  1696
1700  1699  O     -2.739516   -9.655232  -23.960882     1  1700  1701
1701  1700  H     -2.213123  -10.386828  -24.283232     2  1699
1702  1701  H     -2.229747   -8.876297  -24.183656     2  1699
1703  1702  O    -17.426983   -9.605965  -12.316224     1  1703  1704
1704  1703  H    -16.712169   -9.688156  -11.684942     2  1702
1705  1704  H    -16.998249   -9.647753  -13.171018     2  1702
1706  1705  O    -27.655136   -2.015097  -11.473082     1  1706  1707
1707  1706  H    -26.920999   -2.135540  -12.075385     2  1705
1708  1707  H    -28.305118   -2.658632  -11.755249     2  1705
1709  1708  O      7.916612   17.152831   27.274201     1  1709  1710
1710  1709  H      7.882471   17.197971   26.318675     2  1708
1711  1710  H      8.560865   16.469527   27.459310     2  1708
1712  1711  O    -22.891673  -16.779686  -12.064811     1  1712  1713
1713  1712  H    -22.877246  -16.801634  -11.107971     2  1711
1714  1713  H    -22.128923  -17.294536  -12.328198     2  1711
1715  1714  O      0.196413  -24.299177  -27.579118     1  1715  1716
1716  1715  H     -0.289126  -24.721638  -28.287646     2  1714
1717  1716  H     -0.472761  -23.844880  -27.067208     2  1714
1718  1717  O    -25.499704   -0.244127  -18.194602     1  1718  1719
1719  1718  H    -25.087468    0.614278  -18.291729     2  1717
1720  1719  H    -24.870692   -0.756309  -17.686423     2  1717
1721  1720  O      1.395383   -0.695093   -9.072792     1  1721  1722
1722  1721  H      0.462415   -0.895973   -9.146612     2  1720
1723  1722  H      1.795956   -1.136803   -9.821567     2  1720
1724  1723  O     -5.333421   -3.196814  -22.579284     1  1724  1725
1725  1724  H     -5.000902   -4.051276  -22.854164     2  1723
1726  1725  H     -6.096675   -3.399062  -22.038202     2  1723
1727  1726  O     -4.130803  -17.002940  -21.806544     1  1727  1728
1728  1727  H     -4.819547  -16.396410  -21.534539     2  1726
1729  1728  H     -4.594549  -17.812748  -22.019574     2  1726
1730  1729  O    -24.384390   -3.601687  -15.720882     1  1730  1731
1731  1730  H    -24.772668   -4.182963  -16.374787     2  1729
1732  1731  H    -23.683709   -3.147784  -16.189124     2  1729
1733  1732  O     11.022730   22.401275   18.008103     1  1733  1734
1734  1733  H     10.654400   22.840018   17.241246     2  1732
1735  1734  H     11.533211   21.676219   17.647641     2  1732
1736  1735  O    -30.054873   -7.836736  -11.123790     1  1736  1737
1737  1736  H    -30.148506   -8.720114  -11.480311     2  1735
1738  1737  H    -29.111753   -7.724800  -11.004508     2  1735
1739  1738  O     -7.516224   -6.302942  -18.484532     1  1739  1740
1740  1739  H     -7.141246   -6.279058  -19.364903     2  1738
1741  1740  H     -6.924359   -5.766665  -17.956958     2  1738
1742  1741  O     -7.132901   -2.248932   -9.304668     1  1742  1743
1743  1742  H     -7.168038   -3.038777   -9.844243     2  1741
1744  1743  H     -7.516240   -1.565500   -9.854398     2  1741
1745  1744  O     34.657964   -7.094499   -5.425860     1  1745  1746
1746  1745  H     34.474673   -7.712161   -6.133765     2  1744
1747  1746  H     35.517889   -7.355515   -5.096268     2  1744
1748  1747  O     23.821538   21.266460    8.376871     1  1748  1749
1749  1748  H     24.609838   20.728769    8.452390     2  1747
1750  1749  H     23.750845   21.708851    9.222758     2  1747
1751  1750  O    -21.199085    4.560042  -15.578149     1  1751  1752
1752  1751  H    -21.264830    5.213863  -14.882140     2  1750
1753  1752  H    -21.731683    3.826902  -15.269805     2  1750
1754  1753  O     -4.278699    2.676509   -3.394453     1  1754  1755
1755  1754  H     -4.004220    3.580460   -3.548608     2  1753
1756  1755  H     -4.494170    2.646777   -2.462294     2  1753
1757  1756  O     23.188960   28.206632   -0.721469     1  1757  1758
1758  1757  H     22.268043   28.422444   -0.574609     2  1756
1759  1758  H     23.667311   28.979916   -0.422394     2  1756
1760  1759  O    -14.191387   -1.224024  -18.604999     1  1760  1761
1761  1760  H    -13.599024   -1.961391  -18.457937     2  1759
1762  1761  H    -15.010338   -1.486576  -18.184740     2  1759
1763  1762  O     -5.104248   -1.176109  -16.864644     1  1763  1764
1764  1763  H     -4.217600   -0.867612  -16.677784     2  1762
1765  1764  H     -5.629370   -0.377751  -16.920347     2  1762
1766  1765  O     -7.261665    2.690647  -31.650800     1  1766  1767
1767  1766  H     -8.117755    3.118001  -31.677432     2  1765
1768  1767  H     -7.088519    2.558052  -30.718775     2  1765
1769  1768  O     -7.128751  -12.540340   -1.485118     1  1769  1770
1770  1769  H     -6.790981  -11.862847   -2.070905     2  1768
1771  1770  H     -7.988740  -12.217727   -1.215727     2  1768
1772  1771  O     26.554328   19.252026    7.121573     1  1772  1773
1773  1772  H     27.405355   19.130588    6.700577     2  1771
1774  1773  H     25.950072   19.417740    6.397939     2  1771
1775  1774  O    -14.207168   -6.882146  -23.124988     1  1775  1776
1776  1775  H    -13.956008   -6.735025  -22.213118     2  1774
1777  1776  H    -13.568954   -6.381741  -23.633426     2  1774
1778  1777  O     -5.976360  -11.058753   35.654236     1  1778  1779
1779  1778  H     -5.417161  -11.383492   34.948494     2  1777
1780  1779  H     -6.081069  -10.125806   35.467480     2  1777
1781  1780  O    -35.048280   17.658461    1.648500     1  1781  1782
1782  1781  H    -35.243338   18.237162    2.385581     2  1780
1783  1782  H    -35.756129   17.014151    1.655387     2  1780
1784  1783  O     -4.236690  -11.497085  -11.875220     1  1784  1785
1785  1784  H     -3.946452  -12.038181  -11.140912     2  1783
1786  1785  H     -4.726103  -12.097776  -12.437248     2  1783
1787  1786  O    -27.527457   -4.821450   -9.561175     1  1787  1788
1788  1787  H    -27.460240   -4.325028   -8.745528     2  1786
1789  1788  H    -28.039798   -4.259561  -10.142568     2  1786
1790  1789  O     -8.098802  -18.516253  -22.350520     1  1790  1791
1791  1790  H     -8.978925  -18.726289  -22.662771     2  1789
1792  1791  H     -7.876334  -17.697090  -22.792913     2  1789
1793  1792  O    -27.196373  -11.406225   -4.196689     1  1793  1794
1794  1793  H    -26.566588  -11.603119   -3.503266     2  1792
1795  1794  H    -26.793301  -10.692820   -4.691481     2  1792
1796  1795  O    -18.243155   -1.203542  -13.945721     1  1796  1797
1797  1796  H    -17.497107   -1.211242  -13.346067     2  1795
1798  1797  H    -18.234738   -2.070945  -14.350410     2  1795
1799  1798  O     -6.027540  -10.751097  -33.698312     1  1799  1800
1800  1799  H     -5.788881  -11.532161  -34.197525     2  1798
1801  1800  H     -6.984022  -10.729844  -33.728673     2  1798
1802  1801  O    -29.494442  -13.361671  -10.865213     1  1802  1803
1803  1802  H    -29.498472  -14.106240  -11.466738     2  1801
1804  1803  H    -28.852296  -12.756669  -11.236497     2  1801
1805  1804  O    -11.061123  -21.287137  -10.774821     1  1805  1806
1806  1805  H    -11.489755  -20.918692  -10.002321     2  1804
1807  1806  H    -10.128833  -21.280693  -10.557968     2  1804
1808  1807  O    -13.144505   -3.845498  -14.639833     1  1808  1809
1809  1808  H    -13.844762   -3.595121  -15.242479     2  1807
1810  1809  H    -13.063590   -3.101186  -14.043441     2  1807
1811  1810  O      2.885222   19.529452   29.837868     1  1811  1812
1812  1811  H      3.709155   19.539980   30.324956     2  1810
1813  1812  H      3.148402   19.426889   28.923292     2  1810
1814  1813  O     -3.020607  -28.213780  -11.042520     1  1814  1815
1815  1814  H     -3.109608  -27.622798  -11.790217     2  1813
1816  1815  H     -3.796897  -28.044166  -10.508820     2  1813
1817  1816  O     -7.028553   -1.244064   -4.542801     1  1817  1818
1818  1817  H     -6.896284   -2.102837   -4.141247     2  1816
1819  1818  H     -6.766327   -0.619813   -3.866206     2  1816
1820  1819  O      1.581497  -20.243495  -17.524723     1  1820  1821
1821  1820  H      1.571425  -20.545915  -18.432838     2  1819
1822  1821  H      1.442490  -19.298361  -17.584970     2  1819
1823  1822  O    -10.798393   -5.339418  -15.324619     1  1823  1824
1824  1823  H    -11.218593   -4.994008  -14.536992     2  1822
1825  1824  H     -9.904623   -5.543981  -15.049737     2  1822
1826  1825  O    -24.361905  -13.319040   -9.254785     1  1826  1827
1827  1826  H    -24.942992  -14.063540   -9.410634     2  1825
1828  1827  H    -24.950824  -12.570059   -9.162954     2  1825
1829  1828  O     -9.100213  -10.698113  -33.614582     1  1829  1830
1830  1829  H     -9.117284  -11.099825  -34.483241     2  1828
1831  1830  H     -9.739381   -9.987459  -33.666215     2  1828
1832  1831  O     -4.253874  -14.754148  -31.563721     1  1832  1833
1833  1832  H     -4.162209  -15.623906  -31.952759     2  1831
1834  1833  H     -3.500415  -14.672131  -30.979082     2  1831
1835  1834  O    -28.237427   -4.298376  -14.248388     1  1835  1836
1836  1835  H    -27.357064   -4.446678  -13.903135     2  1834
1837  1836  H    -28.357221   -4.985843  -14.903575     2  1834
1838  1837  O    -26.487916  -15.129676   -9.844368     1  1838  1839
1839  1838  H    -26.387474  -16.067542  -10.007313     2  1837
1840  1839  H    -26.981836  -14.806702  -10.598001     2  1837
1841  1840  O     35.652249  -10.678921   -5.593027     1  1841  1842
1842  1841  H     36.026022  -11.275737   -4.944693     2  1840
1843  1842  H     36.151121   -9.868643   -5.489059     2  1840
1844  1843  O     33.382506   -8.804697    0.130171     1  1844  1845
1845  1844  H     33.885523   -9.326673   -0.494927     2  1843
1846  1845  H     33.050302   -8.068891   -0.384087     2  1843
1847  1846  O    -21.296548  -15.361220  -16.050999     1  1847  1848
1848  1847  H    -20.762766  -15.470004  -15.263932     2  1846
1849  1848  H    -21.086712  -16.123522  -16.590533     2  1846
1850  1849  O     -6.828264  -15.288829   -2.777251     1  1850  1851
1851  1850  H     -6.340776  -15.207709   -3.597011     2  1849
1852  1851  H     -6.703845  -14.446630   -2.339699     2  1849
1853  1852  O      4.066944  -18.909561  -13.744350     1  1853  1854
1854  1853  H      3.353868  -18.271685  -13.714887     2  1852
1855  1854  H      3.981073  -19.326073  -14.601891     2  1852
1856  1855  O     -1.342506  -20.645624  -17.636360     1  1856  1857
1857  1856  H     -1.238954  -21.592787  -17.727955     2  1855
1858  1857  H     -0.534755  -20.355785  -17.212374     2  1855
1859  1858  O     16.657220   31.185752    2.684528     1  1859  1860
1860  1859  H     16.295002   30.814182    1.880187     2  1858
1861  1860  H     16.037225   31.871569    2.932507     2  1858
1862  1861  O     -8.692642   -4.585078   -7.118105     1  1862  1863
1863  1862  H     -9.545635   -4.185584   -7.288515     2  1861
1864  1863  H     -8.129957   -4.258070   -7.820020     2  1861
1865  1864  O    -13.176117    2.255009   -2.996459     1  1865  1866
1866  1865  H    -12.934167    2.771496   -3.765181     2  1864
1867  1866  H    -12.948968    1.355148   -3.230734     2  1864
1868  1867  O    -11.478428   -8.897936   32.676043     1  1868  1869
1869  1868  H    -10.596132   -9.234998   32.831519     2  1867
1870  1869  H    -11.741888   -8.519193   33.514717     2  1867
1871  1870  O    -10.703100  -10.734524  -26.613908     1  1871  1872
1872  1871  H    -10.938429  -11.077058  -27.476185     2  1870
1873  1872  H    -11.247483   -9.954234  -26.508897     2  1870
1874  1873  O    -31.943897  -19.336804    3.062108     1  1874  1875
1875  1874  H    -32.608587  -20.020351    2.977363     2  1873
1876  1875  H    -32.125058  -18.929601    3.909220     2  1873
1877  1876  O     -4.202144   -7.124519  -18.148769     1  1877  1878
1878  1877  H     -4.400103   -7.903723  -17.629264     2  1876
1879  1878  H     -4.883316   -7.104818  -18.820965     2  1876
1880  1879  O    -20.346839   -8.961029   -7.612375     1  1880  1881
1881  1880  H    -20.397988   -8.007355   -7.676574     2  1879
1882  1881  H    -19.942152   -9.235591   -8.435222     2  1879
1883  1882  O    -10.116177    3.871809  -11.607055     1  1883  1884
1884  1883  H    -10.342338    3.351672  -10.835990     2  1882
1885  1884  H    -10.150197    4.778830  -11.303105     2  1882
1886  1885  O    -19.505258    3.201666   -6.542447     1  1886  1887
1887  1886  H    -19.285974    3.777013   -7.275333     2  1885
1888  1887  H    -18.826122    3.374214   -5.890347     2  1885
1889  1888  O    -15.151848  -19.084195   -9.240207     1  1889  1890
1890  1889  H    -15.148316  -18.581812   -8.425449     2  1888
1891  1890  H    -16.044798  -19.421812   -9.310103     2  1888
1892  1891  O      1.228312   -3.610956  -30.513642     1  1892  1893
1893  1892  H      0.739109   -2.806101  -30.342998     2  1891
1894  1893  H      0.863750   -4.248182  -29.899420     2  1891
1895  1894  O     16.803370  -30.982988    3.760909     1  1895  1896
1896  1895  H     16.891790  -30.488258    2.946259     2  1894
1897  1896  H     15.858536  -31.062091    3.892302     2  1894
1898  1897  O    -29.830808    1.694824  -10.826100     1  1898  1899
1899  1898  H    -30.073305    0.798981  -11.060391     2  1897
1900  1899  H    -28.928595    1.625396  -10.513974     2  1897
1901  1900  O     -6.451878    0.477480   -2.622532     1  1901  1902
1902  1901  H     -7.003526    0.413214   -1.842925     2  1900
1903  1902  H     -5.642273    0.882071   -2.310961     2  1900
1904  1903  O     -1.377777  -32.014708   -5.761275     1  1904  1905
1905  1904  H     -1.255510  -31.990604   -4.812222     2  1903
1906  1905  H     -2.145624  -31.465192   -5.918357     2  1903
1907  1906  O     -9.493200  -10.834217   -4.661031     1  1907  1908
1908  1907  H     -8.753490  -11.027874   -5.236842     2  1906
1909  1908  H     -9.783032   -9.961833   -4.927817     2  1906
1910  1909  O     -2.265719    0.221235  -32.063849     1  1910  1911
1911  1910  H     -2.546537    0.405085  -32.960271     2  1909
1912  1911  H     -3.044398   -0.136017  -31.636927     2  1909
1913  1912  O     12.695131   19.868912   18.160137     1  1913  1914
1914  1913  H     13.308534   19.608857   18.847407     2  1912
1915  1914  H     12.790052   19.195626   17.486410     2  1912
1916  1915  O     17.064014   21.038837   14.469176     1  1916  1917
1917  1916  H     17.278357   20.502659   15.232590     2  1915
1918  1917  H     16.597602   21.793260   14.829088     2  1915
1919  1918  O     19.386406   25.116512    9.475233     1  1919  1920
1920  1919  H     19.914721   24.326189    9.363411     2  1918
1921  1920  H     18.482294   24.802195    9.479452     2  1918
1922  1921  O    -29.756188    1.857283  -14.440280     1  1922  1923
1923  1922  H    -29.658892    1.111395  -13.848320     2  1921
1924  1923  H    -29.503053    2.615812  -13.914174     2  1921
1925  1924  O     -9.387624  -25.273123   -9.104454     1  1925  1926
1926  1925  H     -9.562061  -24.781366   -8.301971     2  1924
1927  1926  H     -9.226568  -26.168558   -8.806984     2  1924
1928  1927  O     26.530164   15.648065   11.626472     1  1928  1929
1929  1928  H     26.046071   16.043819   12.351224     2  1927
1930  1929  H     26.561226   16.331538   10.957047     2  1927
1931  1930  O     -3.597138  -28.126125   -6.318041     1  1931  1932
1932  1931  H     -3.944473  -28.519991   -5.517755     2  1930
1933  1932  H     -3.995696  -27.256436   -6.350041     2  1930
1934  1933  O    -33.673416  -11.013853   -9.806339     1  1934  1935
1935  1934  H    -34.124471  -11.324435   -9.021278     2  1933
1936  1935  H    -33.580913  -10.070564   -9.672621     2  1933
1937  1936  O    -11.038743  -20.957636  -17.897440     1  1937  1938
1938  1937  H    -11.690217  -20.964866  -18.598696     2  1936
1939  1938  H    -11.497105  -20.577620  -17.147958     2  1936
1940  1939  O     -7.967414   -8.721249  -12.860217     1  1940  1941
1941  1940  H     -7.728763   -9.426702  -13.461561     2  1939
1942  1941  H     -8.594216   -8.189524  -13.350747     2  1939
1943  1942  O      1.673782  -15.708582  -11.092079     1  1943  1944
1944  1943  H      1.280333  -16.444891  -10.623807     2  1942
1945  1944  H      1.845972  -16.047334  -11.970617     2  1942
1946  1945  O    -33.683183  -12.878092    3.831717     1  1946  1947
1947  1946  H    -33.272221  -13.659818    3.462602     2  1945
1948  1947  H    -34.208692  -12.522175    3.115200     2  1945
1949  1948  O    -25.987026  -17.715145  -10.173972     1  1949  1950
1950  1949  H    -26.347537  -18.004209  -11.012247     2  1948
1951  1950  H    -25.592864  -18.502252   -9.798033     2  1948
1952  1951  O      0.233431    0.360630  -33.796725     1  1952  1953
1953  1952  H      0.932085    0.684858  -33.228401     2  1951
1954  1953  H     -0.491352    0.170090  -33.201229     2  1951
1955  1954  O    -17.381944  -11.182359  -23.930241     1  1955  1956
1956  1955  H    -17.039754  -11.080271  -24.818337     2  1954
1957  1956  H    -16.856245  -10.583288  -23.400159     2  1954
1958  1957  O    -11.186506   -8.060651  -15.095742     1  1958  1959
1959  1958  H    -11.931070   -8.417926  -15.579696     2  1957
1960  1959  H    -11.060217   -7.185215  -15.461656     2  1957
1961  1960  O    -16.546104  -15.756791   -7.561802     1  1961  1962
1962  1961  H    -16.867458  -15.572169   -6.679261     2  1960
1963  1962  H    -15.743061  -16.259303   -7.424563     2  1960
1964  1963  O    -12.897653  -13.526970   -2.836991     1  1964  1965
1965  1964  H    -12.728877  -12.591935   -2.952982     2  1963
1966  1965  H    -13.840991  -13.618960   -2.970711     2  1963
1967  1966  O    -13.519090  -24.264984   -3.033298     1  1967  1968
1968  1967  H    -13.283331  -24.390632   -2.114134     2  1966
1969  1968  H    -14.474096  -24.328309   -3.046920     2  1966
1970  1969  O     14.970615  -35.055869    2.991433     1  1970  1971
1971  1970  H     14.683434  -35.744174    2.391438     2  1969
1972  1971  H     15.367219  -35.526595    3.724477     2  1969
1973  1972  O    -31.113322  -10.371004  -11.535546     1  1973  1974
1974  1973  H    -30.385379  -10.512328  -10.930270     2  1972
1975  1974  H    -31.891815  -10.370171  -10.978610     2  1972
1976  1975  O     36.160646   -5.486505  -12.477308     1  1976  1977
1977  1976  H     36.286995   -6.432203  -12.400348     2  1975
1978  1977  H     37.015516   -5.112077  -12.264628     2  1975
1979  1978  O      0.741478   -3.097974  -16.552321     1  1979  1980
1980  1979  H      0.566720   -3.378550  -17.450635     2  1978
1981  1980  H     -0.123282   -3.042507  -16.145695     2  1978
1982  1981  O    -31.311570   -1.381824   -8.090549     1  1982  1983
1983  1982  H    -31.414254   -1.449637   -9.039806     2  1981
1984  1983  H    -32.179425   -1.133088   -7.772445     2  1981
1985  1984  O    -13.381340  -16.372146  -14.888201     1  1985  1986
1986  1985  H    -13.893241  -17.060021  -15.313662     2  1984
1987  1986  H    -12.473226  -16.663529  -14.969791     2  1984
1988  1987  O     -6.011584  -30.623787   -6.163212     1  1988  1989
1989  1988  H     -5.693859  -30.592428   -5.260827     2  1987
1990  1989  H     -5.472959  -31.293812   -6.584141     2  1987
1991  1990  O    -21.157978  -15.979338   -4.948335     1  1991  1992
1992  1991  H    -21.704297  -16.077826   -4.168548     2  1990
1993  1992  H    -21.601945  -15.310354   -5.469473     2  1990
1994  1993  O     20.249975   18.868663    9.560877     1  1994  1995
1995  1994  H     20.134513   18.450801    8.707477     2  1993
1996  1995  H     20.296757   19.804539    9.365479     2  1993
1997  1996  O    -26.378701   -7.973137  -13.419300     1  1997  1998
1998  1997  H    -26.335192   -8.680274  -14.062959     2  1996
1999  1998  H    -25.788418   -7.301326  -13.760574     2  1996
2000  1999  O     -2.127528  -17.220779  -16.018144     1  2000  2001
2001  2000  H     -2.093997  -18.172362  -16.116109     2  1999
2002  2001  H     -2.307707  -16.894941  -16.899958     2  1999
2003  2002  O     17.266367    4.973578   31.652669     1  2003  2004
2004  2003  H     17.450454    4.744956   30.741584     2  2002
2005  2004  H     16.622124    4.325370   31.937290     2  2002
2006  2005  O    -23.174838   -6.000027   -2.038812     1  2006  2007
2007  2006  H    -22.743686   -5.221433   -2.391134     2  2005
2008  2007  H    -22.469554   -6.499310   -1.627082     2  2005
2009  2008  O     -9.178845    2.838649   -6.532345     1  2009  2010
2010  2009  H     -8.692282    2.709155   -5.718269     2  2008
2011  2010  H     -9.523280    1.971641   -6.746573     2  2008
2012  2011  O    -10.509242  -16.332349  -15.566658     1  2012  2013
2013  2012  H    -10.185350  -16.240235  -16.462672     2  2011
2014  2013  H     -9.921854  -16.971740  -15.163685     2  2011
2015  2014  O    -11.355313   -8.453175  -24.371954     1  2015  2016
2016  2015  H    -11.437164   -8.548600  -25.320862     2  2014
2017  2016  H    -12.092222   -8.949910  -24.016353     2  2014
2018  2017  O    -35.457762   -8.442620   -4.853029     1  2018  2019
2019  2018  H    -34.541232   -8.561069   -5.102376     2  2017
2020  2019  H    -35.426132   -8.214132   -3.924038     2  2017
2021  2020  O      2.383852  -13.294386  -29.651485     1  2021  2022
2022  2021  H      2.515343  -13.398781  -28.709124     2  2020
2023  2022  H      3.083240  -12.701875  -29.927201     2  2020
2024  2023  O    -15.375106  -11.499727  -18.122881     1  2024  2025
2025  2024  H    -14.461414  -11.522370  -17.838477     2  2023
2026  2025  H    -15.684980  -12.397882  -18.006580     2  2023
2027  2026  O    -11.330600  -18.406965   -6.681199     1  2027  2028
2028  2027  H    -10.534563  -17.898612   -6.836552     2  2026
2029  2028  H    -11.715269  -18.016652   -5.896395     2  2026
2030  2029  O     19.215698   25.328744    5.689118     1  2030  2031
2031  2030  H     18.529572   25.583748    5.072323     2  2029
2032  2031  H     18.914816   24.495578    6.051796     2  2029
2033  2032  O     -9.259994  -12.119640  -30.582674     1  2033  2034
2034  2033  H    -10.194359  -12.296861  -30.474111     2  2032
2035  2034  H     -9.200154  -11.647764  -31.413327     2  2032
2036  2035  O    -14.349081   -4.213940  -27.596335     1  2036  2037
2037  2036  H    -14.502931   -4.622301  -28.448276     2  2035
2038  2037  H    -14.679788   -3.321111  -27.694935     2  2035
2039  2038  O    -27.298192   -1.599786   -0.427596     1  2039  2040
2040  2039  H    -28.232280   -1.527458   -0.231433     2  2038
2041  2040  H    -27.234240   -2.351243   -1.017048     2  2038
2042  2041  O    -20.476057   -3.741793   -1.024884     1  2042  2043
2043  2042  H    -20.875469   -3.286963   -1.766390     2  2041
2044  2043  H    -21.095992   -3.619167   -0.305943     2  2041
2045  2044  O    -10.659657   -0.582389  -19.632347     1  2045  2046
2046  2045  H     -9.853849   -0.907846  -19.231121     2  2044
2047  2046  H    -11.199641   -0.302377  -18.893265     2  2044
2048  2047  O      2.685884   -6.836062  -33.217359     1  2048  2049
2049  2048  H      2.450030   -5.914378  -33.322736     2  2047
2050  2049  H      2.964137   -6.909722  -32.304462     2  2047
2051  2050  O     -0.125767   -3.022805  -19.375325     1  2051  2052
2052  2051  H     -0.856692   -2.634381  -19.856060     2  2050
2053  2052  H      0.639003   -2.857533  -19.926725     2  2050
2054  2053  O    -22.322356    6.693310   -3.935850     1  2054  2055
2055  2054  H    -21.912505    7.454823   -4.346157     2  2053
2056  2055  H    -21.589014    6.178020   -3.599818     2  2053
2057  2056  O    -12.173118  -15.287565  -12.315313     1  2057  2058
2058  2057  H    -12.755067  -15.520710  -13.038646     2  2056
2059  2058  H    -11.954406  -16.123831  -11.904149     2  2056
2060  2059  O    -19.113736   -6.176106  -11.628702     1  2060  2061
2061  2060  H    -19.870674   -6.437723  -12.152947     2  2059
2062  2061  H    -19.478635   -5.617379  -10.942477     2  2059
2063  2062  O    -17.674277   -8.274212  -20.191325     1  2063  2064
2064  2063  H    -17.749747   -7.326393  -20.080981     2  2062
2065  2064  H    -16.731836   -8.441652  -20.190310     2  2062
2066  2065  O     -8.532618   -0.722060  -11.363398     1  2066  2067
2067  2066  H     -8.130763   -1.119155  -12.136094     2  2065
2068  2067  H     -8.363494    0.215137  -11.459784     2  2065
2069  2068  O     -1.484750   -4.329084   -8.058556     1  2069  2070
2070  2069  H     -0.904320   -5.080758   -8.178221     2  2068
2071  2070  H     -2.367044   -4.697318   -8.105377     2  2068
2072  2071  O    -16.178103   -7.858496  -14.800573     1  2072  2073
2073  2072  H    -15.565094   -7.335053  -15.316769     2  2071
2074  2073  H    -15.916392   -8.764666  -14.963654     2  2071
2075  2074  O     -8.678535  -27.729749   -7.208956     1  2075  2076
2076  2075  H     -8.089518  -27.960348   -7.927367     2  2074
2077  2076  H     -8.275355  -28.119884   -6.433410     2  2074
2078  2077  O     -0.979663    3.506939  -19.679881     1  2078  2079
2079  2078  H     -0.324216    3.021731  -20.181073     2  2077
2080  2079  H     -0.705207    4.421420  -19.747932     2  2077
2081  2080  O     -7.711397  -18.971437   -7.423254     1  2081  2082
2082  2081  H     -6.767063  -19.086852   -7.317691     2  2080
2083  2082  H     -7.890973  -19.266804   -8.315859     2  2080
2084  2083  O    -15.003147   -9.563459  -20.226102     1  2084  2085
2085  2084  H    -14.919534   -9.955147  -19.356722     2  2083
2086  2085  H    -14.896633  -10.297411  -20.831248     2  2083
2087  2086  O    -19.925964  -18.237635   -6.368710     1  2087  2088
2088  2087  H    -19.198140  -18.291824   -5.749382     2  2086
2089  2088  H    -20.601388  -17.744771   -5.902749     2  2086
2090  2089  O    -26.830362  -12.532899   -7.478186     1  2090  2091
2091  2090  H    -27.543518  -13.171183   -7.493494     2  2089
2092  2091  H    -26.794477  -12.191666   -8.371777     2  2089
2093  2092  O    -24.271623   -6.530277  -20.766349     1  2093  2094
2094  2093  H    -24.278713   -7.189841  -21.460004     2  2092
2095  2094  H    -23.352218   -6.462832  -20.508710     2  2092
2096  2095  O     -8.666480   -4.991447   -4.172082     1  2096  2097
2097  2096  H     -9.526500   -5.400416   -4.075417     2  2095
2098  2097  H     -8.233079   -5.502679   -4.855482     2  2095
2099  2098  O    -30.229436   -1.300120    0.103732     1  2099  2100
2100  2099  H    -30.826774   -1.471242    0.831837     2  2098
2101  2100  H    -30.440249   -0.409094   -0.175305     2  2098
2102  2101  O     36.120798   -7.259023   -9.721568     1  2102  2103
2103  2102  H     35.893805   -7.609886  -10.582731     2  2101
2104  2103  H     35.334147   -7.392925   -9.192909     2  2101
2105  2104  O     -5.305221  -13.431202  -34.226814     1  2105  2106
2106  2105  H     -5.104503  -13.842902  -33.386310     2  2104
2107  2106  H     -4.594150  -13.707198  -34.805119     2  2104
2108  2107  O     -1.042356   -7.084164   35.817638     1  2108  2109
2109  2108  H     -1.294529   -6.711753   34.972682     2  2107
2110  2109  H     -1.525890   -7.908565   35.870462     2  2107
2111  2110  O    -17.647976   -6.189645  -29.673747     1  2111  2112
2112  2111  H    -17.542772   -7.130075  -29.529681     2  2110
2113  2112  H    -18.572420   -6.020898  -29.491649     2  2110
2114  2113  O     -0.762439  -12.415331   -7.975920     1  2114  2115
2115  2114  H     -1.137166  -11.991154   -8.747857     2  2113
2116  2115  H     -0.565479  -13.306725   -8.263766     2  2113
2117  2116  O    -27.473036   -7.537175  -10.457550     1  2117  2118
2118  2117  H    -26.659044   -7.786955  -10.894882     2  2116
2119  2118  H    -27.284138   -6.683305  -10.068378     2  2116
2120  2119  O      2.508595  -10.048153  -28.284368     1  2120  2121
2121  2120  H      3.028979  -10.608407  -28.860170     2  2119
2122  2121  H      2.470212  -10.525549  -27.455603     2  2119
2123  2122  O     26.081175   24.952215   -1.401455     1  2123  2124
2124  2123  H     26.233943   25.052875   -2.341009     2  2122
2125  2124  H     25.759203   24.055929   -1.305337     2  2122
2126  2125  O     -5.245994   -7.909193  -24.395543     1  2126  2127
2127  2126  H     -6.037245   -8.411944  -24.588922     2  2125
2128  2127  H     -4.526217   -8.492971  -24.635032     2  2125
2129  2128  O      0.732203   -8.483317  -32.513610     1  2129  2130
2130  2129  H      1.238770   -7.708463  -32.756969     2  2128
2131  2130  H      0.470771   -8.324028  -31.606685     2  2128
2132  2131  O    -19.830349  -31.773918   -0.764580     1  2132  2133
2133  2132  H    -19.677928  -30.959041   -1.243095     2  2131
2134  2133  H    -20.782824  -31.867227   -0.746807     2  2131
2135  2134  O    -26.494847   -9.336086    5.642628     1  2135  2136
2136  2135  H    -27.396311   -9.045021    5.505235     2  2134
2137  2136  H    -26.343413   -9.982002    4.952633     2  2134
2138  2137  O      9.969066   15.397829   28.073718     1  2138  2139
2139  2138  H      9.602411   15.114652   28.911337     2  2137
2140  2139  H     10.898237   15.175109   28.130904     2  2137
2141  2140  O     11.530504   29.735135    4.444802     1  2141  2142
2142  2141  H     10.978505   29.071156    4.857913     2  2140
2143  2142  H     11.564165   30.449183    5.081381     2  2140
2144  2143  O    -10.526424  -13.554337  -13.951556     1  2144  2145
2145  2144  H    -10.216663  -12.868656  -13.359847     2  2143
2146  2145  H    -10.983675  -14.173671  -13.382715     2  2143
2147  2146  O    -13.443906   -8.865402  -10.177829     1  2147  2148
2148  2147  H    -14.030218   -8.421574  -10.790599     2  2146
2149  2148  H    -13.844061   -8.726484   -9.319453     2  2146
2150  2149  O     27.321543   22.112283    2.312886     1  2150  2151
2151  2150  H     27.665934   22.798632    1.741440     2  2149
2152  2151  H     27.951206   22.060330    3.031953     2  2149
2153  2152  O    -20.159260   -8.363836  -21.543065     1  2153  2154
2154  2153  H    -20.952179   -8.416652  -21.009472     2  2152
2155  2154  H    -19.442699   -8.491557  -20.921407     2  2152
2156  2155  O     -1.196314   -7.878156  -20.074876     1  2156  2157
2157  2156  H     -0.616987   -8.552110  -19.719351     2  2155
2158  2157  H     -1.265629   -7.228072  -19.375722     2  2155
2159  2158  O    -15.319529  -11.908524  -22.151820     1  2159  2160
2160  2159  H    -15.707118  -12.272767  -22.947642     2  2158
2161  2160  H    -15.239934  -12.656347  -21.559658     2  2158
2162  2161  O    -33.332036   -8.905012   -0.865964     1  2162  2163
2163  2162  H    -33.610798   -9.602742   -1.459004     2  2161
2164  2163  H    -33.901021   -8.165864   -1.080785     2  2161
2165  2164  O     -6.315286   -6.722316  -20.892159     1  2165  2166
2166  2165  H     -5.389373   -6.566833  -21.078552     2  2164
2167  2166  H     -6.649373   -7.153308  -21.678838     2  2164
2168  2167  O     21.445538   23.844418    3.471909     1  2168  2169
2169  2168  H     21.936285   24.257610    4.182311     2  2167
2170  2169  H     20.901540   23.187528    3.906412     2  2167
2171  2170  O    -11.938757   -5.974035  -36.315846     1  2171  2172
2172  2171  H    -12.008115   -5.101364  -36.702973     2  2170
2173  2172  H    -12.100183   -5.836055  -35.382500     2  2170
2174  2173  O    -24.755869   -1.651228   -5.882693     1  2174  2175
2175  2174  H    -25.108239   -1.208602   -6.654799     2  2173
2176  2175  H    -25.516469   -2.066411   -5.476069     2  2173
2177  2176  O    -15.059769   -4.343676   -8.259481     1  2177  2178
2178  2177  H    -14.396978   -4.613615   -8.895148     2  2176
2179  2178  H    -15.891000   -4.612546   -8.650625     2  2176
2180  2179  O     21.492834   27.702200    3.561555     1  2180  2181
2181  2180  H     22.415207   27.457324    3.635691     2  2179
2182  2181  H     21.088479   26.974286    3.089465     2  2179
2183  2182  O    -24.169265   -9.874945  -12.632857     1  2183  2184
2184  2183  H    -24.977948  -10.157874  -13.059724     2  2182
2185  2184  H    -23.503249  -10.483194  -12.953306     2  2182
2186  2185  O      8.299590  -28.771392  -10.125868     1  2186  2187
2187  2186  H      9.079195  -28.587036  -10.649757     2  2185
2188  2187  H      8.640337  -29.131238   -9.306945     2  2185
2189  2188  O    -30.482169    6.619971  -14.521712     1  2189  2190
2190  2189  H    -31.221824    7.081765  -14.126883     2  2188
2191  2190  H    -30.884606    5.941529  -15.063922     2  2188
2192  2191  O    -25.668316   -3.947471  -13.209997     1  2192  2193
2193  2192  H    -25.175464   -4.268824  -12.454974     2  2191
2194  2193  H    -25.005598   -3.803191  -13.885438     2  2191
2195  2194  O      5.755067  -12.706664  -14.186673     1  2195  2196
2196  2195  H      6.231654  -11.881577  -14.095410     2  2194
2197  2196  H      6.406769  -13.382240  -13.999287     2  2194
2198  2197  O    -22.369222    0.939037   -2.770569     1  2198  2199
2199  2198  H    -22.516573    1.704976   -3.325418     2  2197
2200  2199  H    -21.567659    1.142497   -2.288559     2  2197
2201  2200  O    -26.422828   -8.019336   -4.276521     1  2201  2202
2202  2201  H    -26.387144   -8.365097   -5.168378     2  2200
2203  2202  H    -27.100734   -7.344282   -4.307784     2  2200
2204  2203  O    -23.722866   -9.384499   -8.449000     1  2204  2205
2205  2204  H    -23.419338   -9.505459   -7.549295     2  2203
2206  2205  H    -22.949516   -9.551710   -8.987705     2  2203
2207  2206  O    -11.829361   -9.882436  -29.432743     1  2207  2208
2208  2207  H    -12.597576   -9.314563  -29.372766     2  2206
2209  2208  H    -12.129509  -10.639941  -29.935067     2  2206
2210  2209  O    -10.554487   -6.076701  -23.353178     1  2210  2211
2211  2210  H    -11.111156   -6.785675  -23.675213     2  2209
2212  2211  H    -10.662214   -5.375978  -23.996306     2  2209
2213  2212  O    -23.687396  -16.002615  -14.599522     1  2213  2214
2214  2213  H    -23.380175  -16.061165  -13.694857     2  2212
2215  2214  H    -22.940161  -15.652431  -15.084540     2  2212
2216  2215  O      4.041808   13.793179  -33.941800     1  2216  2217
2217  2216  H      3.267206   14.335484  -33.793037     2  2215
2218  2217  H      4.770022   14.414202  -33.958090     2  2215
2219  2218  O     -2.113759  -19.681266  -11.663344     1  2219  2220
2220  2219  H     -1.680691  -18.841562  -11.816902     2  2218
2221  2220  H     -2.660347  -19.814555  -12.437751     2  2218
2222  2221  O     -9.589785   -3.147787  -35.472069     1  2222  2223
2223  2222  H     -9.365916   -3.756998  -34.768523     2  2221
2224  2223  H     -9.233607   -3.552964  -36.262765     2  2221
2225  2224  O    -15.550048  -19.137251   -2.965779     1  2225  2226
2226  2225  H    -15.345032  -18.486512   -3.637149     2  2224
2227  2226  H    -15.322801  -18.709876   -2.139982     2  2224
2228  2227  O    -17.264069    5.254599  -19.968923     1  2228  2229
2229  2228  H    -17.392074    4.516524  -19.373027     2  2227
2230  2229  H    -17.908559    5.117109  -20.663157     2  2227
2231  2230  O    -14.036438  -32.538322   -7.333585     1  2231  2232
2232  2231  H    -14.140431  -31.644932   -7.006063     2  2230
2233  2232  H    -14.858670  -32.725051   -7.786685     2  2230
2234  2233  O     -5.019338  -21.120192  -14.137896     1  2234  2235
2235  2234  H     -4.394100  -20.403173  -14.032099     2  2233
2236  2235  H     -4.960932  -21.354843  -15.064049     2  2233
2237  2236  O    -28.730442   -1.444078   -7.526729     1  2237  2238
2238  2237  H    -28.186788   -1.032820   -8.198695     2  2236
2239  2238  H    -29.613215   -1.116278   -7.698459     2  2236
2240  2239  O     -7.256617  -10.465002  -14.846568     1  2240  2241
2241  2240  H     -7.141554  -11.414099  -14.893558     2  2239
2242  2241  H     -7.846875  -10.258644  -15.571305     2  2239
2243  2242  O     -7.726335  -24.035504  -10.960167     1  2243  2244
2244  2243  H     -7.117814  -24.767993  -11.057094     2  2242
2245  2244  H     -8.081753  -24.134041  -10.076878     2  2242
2246  2245  O    -26.907705  -18.671991   -3.095796     1  2246  2247
2247  2246  H    -27.803105  -18.348377   -2.996988     2  2245
2248  2247  H    -26.640901  -18.914365   -2.209060     2  2245
2249  2248  O    -11.282067   -0.728270   -8.897823     1  2249  2250
2250  2249  H    -12.110663   -1.110840   -9.186442     2  2248
2251  2250  H    -10.637212   -1.422660   -9.032795     2  2248
2252  2251  O     -4.793655    0.881958   -9.368293     1  2252  2253
2253  2252  H     -4.177668    0.368644   -8.845511     2  2251
2254  2253  H     -4.881121    0.391876  -10.185850     2  2251
2255  2254  O      8.674909   31.842938   13.065084     1  2255  2256
2256  2255  H      8.689327   30.999717   13.517856     2  2254
2257  2256  H      9.578935   31.978346   12.781122     2  2254
2258  2257  O      8.624281   25.353964   18.702013     1  2258  2259
2259  2258  H      7.963597   25.938433   18.330359     2  2257
2260  2259  H      9.227066   25.182279   17.978545     2  2257
2261  2260  O     21.314170    0.007659   32.127364     1  2261  2262
2262  2261  H     20.899658   -0.854125   32.085636     2  2260
2263  2262  H     20.713458    0.537794   32.651133     2  2260
2264  2263  O     -1.746971  -28.119392  -13.685424     1  2264  2265
2265  2264  H     -1.249832  -28.657936  -14.301097     2  2263
2266  2265  H     -1.079910  -27.680969  -13.157176     2  2263
2267  2266  O    -31.575635   -8.180673   -7.917475     1  2267  2268
2268  2267  H    -30.887581   -8.235282   -8.580673     2  2266
2269  2268  H    -32.391988   -8.191472   -8.417158     2  2266
2270  2269  O     -7.912913   -9.155577   -8.092974     1  2270  2271
2271  2270  H     -8.582868   -8.511963   -8.323522     2  2269
2272  2271  H     -7.084030   -8.690822   -8.207816     2  2269
2273  2272  O    -27.334910  -10.128220  -11.989536     1  2273  2274
2274  2273  H    -27.926952  -10.423441  -12.681318     2  2272
2275  2274  H    -27.057540   -9.255242  -12.267398     2  2272
2276  2275  O    -18.358644  -16.653946   -9.612714     1  2276  2277
2277  2276  H    -17.824862  -16.333000   -8.885871     2  2275
2278  2277  H    -17.938736  -16.296344  -10.395038     2  2275
2279  2278  O    -20.427184  -21.049526    0.418936     1  2279  2280
2280  2279  H    -19.483148  -21.046021    0.577098     2  2278
2281  2280  H    -20.771737  -20.378520    1.008229     2  2278
2282  2281  O    -33.273771   -1.818605  -13.037537     1  2282  2283
2283  2282  H    -33.884093   -1.081981  -13.071045     2  2281
2284  2283  H    -33.489849   -2.344512  -13.807578     2  2281
2285  2284  O     -2.780293  -32.831166  -14.028338     1  2285  2286
2286  2285  H     -3.021166  -33.032501  -13.124083     2  2284
2287  2286  H     -3.364599  -32.115523  -14.278683     2  2284
2288  2287  O    -22.239285   -3.818912   -3.213245     1  2288  2289
2289  2288  H    -21.871730   -3.321315   -3.943678     2  2287
2290  2289  H    -23.143835   -3.513210   -3.145668     2  2287
2291  2290  O     -4.060252  -23.769415  -13.186558     1  2291  2292
2292  2291  H     -4.217407  -22.949622  -13.655039     2  2290
2293  2292  H     -3.145897  -23.715483  -12.908567     2  2290
2294  2293  O    -21.850437  -12.425654   -8.430260     1  2294  2295
2295  2294  H    -22.731566  -12.718616   -8.662677     2  2293
2296  2295  H    -21.646666  -11.745300   -9.071998     2  2293
2297  2296  O    -27.595126    1.741335   -6.444028     1  2297  2298
2298  2297  H    -27.768090    1.303277   -5.610710     2  2296
2299  2298  H    -26.768349    1.365087   -6.745871     2  2296
2300  2299  O      3.194623  -18.404401   -7.383901     1  2300  2301
2301  2300  H      2.973321  -18.379549   -6.452966     2  2299
2302  2301  H      3.741023  -19.184436   -7.479945     2  2299
2303  2302  O     -5.804981   -9.293292  -11.071995     1  2303  2304
2304  2303  H     -6.580873   -9.136701  -11.610236     2  2302
2305  2304  H     -5.281927   -9.913684  -11.579696     2  2302
2306  2305  O     -7.824768  -14.316157  -31.383203     1  2306  2307
2307  2306  H     -8.324383  -13.516524  -31.218266     2  2305
2308  2307  H     -6.909794  -14.035616  -31.364485     2  2305
2309  2308  O    -18.669243  -28.640545   -6.656236     1  2309  2310
2310  2309  H    -19.601788  -28.436770   -6.585061     2  2308
2311  2310  H    -18.639178  -29.590464   -6.770177     2  2308
2312  2311  O     -6.793482   -2.023103  -13.540670     1  2312  2313
2313  2312  H     -7.175976   -2.759324  -13.063273     2  2311
2314  2313  H     -6.984142   -2.208305  -14.460224     2  2311
2315  2314  O    -11.516156  -19.146899   -2.766073     1  2315  2316
2316  2315  H    -12.107734  -19.133393   -2.013687     2  2314
2317  2316  H    -11.583794  -20.038162   -3.108573     2  2314
2318  2317  O      0.259647  -26.608942  -12.670407     1  2318  2319
2319  2318  H      0.507385  -26.190736  -13.495004     2  2317
2320  2319  H      1.063041  -27.029279  -12.363639     2  2317
2321  2320  O     -5.402250  -15.827097  -10.102265     1  2321  2322
2322  2321  H     -4.640761  -15.313259  -10.371217     2  2320
2323  2322  H     -6.117967  -15.498153  -10.646119     2  2320
2324  2323  O    -25.969839   -1.198022  -14.310580     1  2324  2325
2325  2324  H    -26.329794   -0.712202  -15.052633     2  2323
2326  2325  H    -25.749832   -2.057333  -14.670322     2  2323
2327  2326  O    -24.615546  -11.284788  -17.575942     1  2327  2328
2328  2327  H    -24.870180  -12.133387  -17.938258     2  2326
2329  2328  H    -23.777522  -11.450007  -17.143912     2  2326
2330  2329  O     -5.454069   -5.706792  -13.784845     1  2330  2331
2331  2330  H     -5.120345   -6.006482  -12.939241     2  2329
2332  2331  H     -5.278652   -4.765832  -13.792249     2  2329
2333  2332  O     -6.546633  -21.045948  -11.674799     1  2333  2334
2334  2333  H     -7.171151  -21.754044  -11.832306     2  2332
2335  2334  H     -5.949833  -21.081617  -12.422322     2  2332
2336  2335  O     33.799623   -9.474137   -3.057125     1  2336  2337
2337  2336  H     32.929421   -9.457166   -3.455488     2  2335
2338  2337  H     34.329973   -8.904909   -3.614745     2  2335
2339  2338  O     -2.878223   -0.747268   -7.800557     1  2339  2340
2340  2339  H     -3.141661   -1.265362   -7.040024     2  2338
2341  2340  H     -2.072607   -1.163498   -8.107096     2  2338
2342  2341  O    -14.163117  -12.680390  -12.077286     1  2342  2343
2343  2342  H    -13.390109  -13.092311  -11.691266     2  2341
2344  2343  H    -14.836674  -12.753009  -11.401063     2  2341
2345  2344  O    -12.044495   -2.808759  -17.724789     1  2345  2346
2346  2345  H    -12.456261   -3.670036  -17.654911     2  2344
2347  2346  H    -11.134270   -2.995840  -17.954401     2  2344
2348  2347  O     -9.580070  -17.576248   -0.977634     1  2348  2349
2349  2348  H     -9.803486  -16.894034   -1.610801     2  2347
2350  2349  H     -9.913729  -18.384207   -1.367641     2  2347
2351  2350  O     -8.193386  -25.379645   -3.687220     1  2351  2352
2352  2351  H     -8.026258  -26.306842   -3.518085     2  2350
2353  2352  H     -9.135872  -25.330951   -3.847157     2  2350
2354  2353  O     -0.474217   27.973793   23.297226     1  2354  2355
2355  2354  H     -0.433950   27.064262   23.592800     2  2353
2356  2355  H     -0.946019   27.935109   22.465278     2  2353
2357  2356  O      1.529812  -26.766918   -3.498919     1  2357  2358
2358  2357  H      2.366777  -26.732901   -3.962128     2  2356
2359  2358  H      1.210939  -25.864501   -3.512891     2  2356
2360  2359  O      8.195375  -27.096152  -12.918401     1  2360  2361
2361  2360  H      7.816353  -27.400983  -13.742812     2  2359
2362  2361  H      7.792609  -27.650147  -12.249745     2  2359
2363  2362  O    -19.888386  -14.287702   -9.516512     1  2363  2364
2364  2363  H    -20.798380  -14.411134   -9.246498     2  2362
2365  2364  H    -19.508659  -15.165927   -9.488988     2  2362
2366  2365  O    -25.778943    3.534347    0.811735     1  2366  2367
2367  2366  H    -25.665772    4.316874    1.351248     2  2365
2368  2367  H    -26.299149    3.830891    0.064956     2  2365
2369  2368  O     -5.301043    1.248068  -18.554156     1  2369  2370
2370  2369  H     -5.874630    1.595802  -17.871286     2  2368
2371  2370  H     -4.643401    1.930987  -18.685916     2  2368
2372  2371  O    -18.054033   -1.012677   -1.073869     1  2372  2373
2373  2372  H    -18.337865   -0.100957   -1.140485     2  2371
2374  2373  H    -18.055485   -1.196450   -0.134477     2  2371
2375  2374  O    -30.638777  -14.486534   -4.617078     1  2375  2376
2376  2375  H    -29.916755  -14.282619   -4.022659     2  2374
2377  2376  H    -30.231208  -14.535530   -5.481785     2  2374
2378  2377  O     -6.915020   -0.299740  -35.554047     1  2378  2379
2379  2378  H     -6.270646   -0.879595  -35.148114     2  2377
2380  2379  H     -6.771624    0.548953  -35.135251     2  2377
2381  2380  O    -13.721904   -5.643858  -10.322977     1  2381  2382
2382  2381  H    -14.523848   -6.112435  -10.554391     2  2380
2383  2382  H    -13.249159   -6.246310   -9.748698     2  2380
2384  2383  O     -3.950026  -12.214409   -4.704096     1  2384  2385
2385  2384  H     -3.132224  -12.314218   -4.216788     2  2383
2386  2385  H     -4.515430  -11.706147   -4.122529     2  2383
2387  2386  O    -29.503274    4.345717   -6.813839     1  2387  2388
2388  2387  H    -30.400579    4.222352   -6.504230     2  2386
2389  2388  H    -29.090181    3.489834   -6.699604     2  2386
2390  2389  O    -30.299888   -0.981689  -18.101450     1  2390  2391
2391  2390  H    -30.429178   -0.068485  -18.357524     2  2389
2392  2391  H    -29.502764   -0.971810  -17.571613     2  2389
2393  2392  O      8.966109  -30.255747   -7.986305     1  2393  2394
2394  2393  H      8.410231  -30.892544   -7.537171     2  2392
2395  2394  H      9.734682  -30.757493   -8.257925     2  2392
2396  2395  O     -8.290867  -10.443350   17.693486     1  2396  2397
2397  2396  H     -7.706617   -9.719555   17.467648     2  2395
2398  2397  H     -7.710093  -11.122470   18.036604     2  2395
2399  2398  O    -34.105798   10.999888    1.156883     1  2399  2400
2400  2399  H    -33.812327   10.097407    1.031839     2  2398
2401  2400  H    -34.974794   10.917422    1.549663     2  2398
2402  2401  O    -30.855512    1.353221   -0.532408     1  2402  2403
2403  2402  H    -30.067543    1.819026   -0.252475     2  2401
2404  2403  H    -31.181928    1.859349   -1.276396     2  2401
2405  2404  O    -26.570047   -5.738319   20.838969     1  2405  2406
2406  2405  H    -26.757872   -4.990929   20.271200     2  2404
2407  2406  H    -26.602585   -6.496767   20.255934     2  2404
2408  2407  O     -0.557758  -10.610497   31.855731     1  2408  2409
2409  2408  H     -1.373076  -10.118962   31.756324     2  2407
2410  2409  H     -0.836564  -11.521422   31.949084     2  2407
2411  2410  O    -19.616696  -20.470647    8.767088     1  2411  2412
2412  2411  H    -19.820193  -20.173996    9.654116     2  2410
2413  2412  H    -19.481220  -19.664240    8.269508     2  2410
2414  2413  O     28.306556   23.799507    0.435726     1  2414  2415
2415  2414  H     27.606201   24.058648   -0.163090     2  2413
2416  2415  H     29.092020   24.215872    0.080875     2  2413
2417  2416  O    -14.477647   -9.850295   27.670234     1  2417  2418
2418  2417  H    -15.061922  -10.556212   27.393582     2  2416
2419  2418  H    -13.709762   -9.939208   27.105719     2  2416
2420  2419  O     10.071501   13.910092  -29.271495     1  2420  2421
2421  2420  H     10.425606   13.208658  -29.818149     2  2419
2422  2421  H     10.795799   14.528499  -29.175598     2  2419
2423  2422  O      4.194110  -24.213998   24.202675     1  2423  2424
2424  2423  H      4.418275  -23.355868   23.842681     2  2422
2425  2424  H      3.782296  -24.679506   23.474703     2  2422
2426  2425  O     30.935837    7.928645   -6.674700     1  2426  2427
2427  2426  H     31.634830    8.552051   -6.872201     2  2425
2428  2427  H     30.816531    7.994101   -5.727223     2  2425
2429  2428  O     -3.681085  -24.740663    4.670679     1  2429  2430
2430  2429  H     -3.142492  -24.695097    5.460661     2  2428
2431  2430  H     -3.410042  -23.983594    4.151434     2  2428
2432  2431  O     -6.905812  -12.283777   11.994675     1  2432  2433
2433  2432  H     -6.865406  -13.039292   11.408333     2  2431
2434  2433  H     -7.828042  -12.222181   12.243532     2  2431
2435  2434  O      8.024156   12.743120  -33.253274     1  2435  2436
2436  2435  H      7.754479   13.629438  -33.493993     2  2434
2437  2436  H      8.928010   12.840353  -32.953564     2  2434
2438  2437  O     -1.460555  -27.213633   12.055603     1  2438  2439
2439  2438  H     -2.351561  -26.872572   12.133169     2  2437
2440  2439  H     -1.573608  -28.111723   11.744338     2  2437
2441  2440  O    -15.590188  -21.732231    1.968962     1  2441  2442
2442  2441  H    -14.669052  -21.767238    2.226863     2  2440
2443  2442  H    -15.578323  -21.852968    1.019481     2  2440
2444  2443  O     -7.661952  -18.534230   22.018076     1  2444  2445
2445  2444  H     -7.877652  -18.878191   22.884907     2  2443
2446  2445  H     -8.476613  -18.139560   21.706957     2  2443
2447  2446  O    -32.382905   -5.569464   11.945167     1  2447  2448
2448  2447  H    -33.025813   -6.222330   12.222055     2  2446
2449  2448  H    -32.865175   -4.994832   11.350655     2  2446
2450  2449  O    -12.799326   -4.928281   -1.610861     1  2450  2451
2451  2450  H    -11.970351   -4.948349   -2.089012     2  2449
2452  2451  H    -12.685514   -4.233577   -0.962274     2  2449
2453  2452  O     -2.824030   -5.521029   19.042649     1  2453  2454
2454  2453  H     -3.339238   -4.796935   19.398288     2  2452
2455  2454  H     -2.784897   -5.348411   18.101956     2  2452
2456  2455  O    -12.914042  -22.012840    2.590649     1  2456  2457
2457  2456  H    -12.408870  -22.334723    1.844040     2  2455
2458  2457  H    -12.254036  -21.766026    3.238496     2  2455
2459  2458  O      0.364173  -16.182255   17.491561     1  2459  2460
2460  2459  H      0.730225  -17.027488   17.231138     2  2458
2461  2460  H     -0.211864  -16.386889   18.228133     2  2458
2462  2461  O    -12.377125  -17.192684   20.416267     1  2462  2463
2463  2462  H    -12.727578  -17.007352   19.545022     2  2461
2464  2463  H    -13.123482  -17.536796   20.906949     2  2461
2465  2464  O     31.620594    1.102148   15.456605     1  2465  2466
2466  2465  H     32.017728    0.427308   14.906054     2  2464
2467  2466  H     32.276119    1.277558   16.131699     2  2464
2468  2467  O     -9.699942  -13.997732    0.317745     1  2468  2469
2469  2468  H     -9.955804  -14.281532    1.195369     2  2467
2470  2469  H    -10.218493  -14.544902   -0.272120     2  2467
2471  2470  O    -29.117057   -3.158418    3.157407     1  2471  2472
2472  2471  H    -30.068269   -3.143567    3.051547     2  2470
2473  2472  H    -28.963111   -3.795870    3.854678     2  2470
2474  2473  O    -30.135350   -5.024313   13.749079     1  2474  2475
2475  2474  H    -29.557227   -5.754763   13.528971     2  2473
2476  2475  H    -30.908147   -5.155958   13.199820     2  2473
2477  2476  O    -15.972670   -7.936758   15.240479     1  2477  2478
2478  2477  H    -15.851105   -7.116804   14.761805     2  2476
2479  2478  H    -16.064503   -8.601678   14.558070     2  2476
2480  2479  O    -17.811348  -13.900944    0.564335     1  2480  2481
2481  2480  H    -18.325782  -14.702587    0.658987     2  2479
2482  2481  H    -17.830173  -13.499719    1.433183     2  2479
2483  2482  O    -25.184758  -11.128662   12.296157     1  2483  2484
2484  2483  H    -24.912974  -10.218378   12.178898     2  2482
2485  2484  H    -25.023232  -11.538702   11.446446     2  2482
2486  2485  O    -18.523428  -17.460620    5.006172     1  2486  2487
2487  2486  H    -17.707325  -17.307109    5.482241     2  2485
2488  2487  H    -18.251127  -17.585158    4.097011     2  2485
2489  2488  O     -4.235976   -0.476082   12.976494     1  2489  2490
2490  2489  H     -4.179126    0.447370   13.221926     2  2488
2491  2490  H     -4.991188   -0.807478   13.462357     2  2488
2492  2491  O      0.198954  -23.326900   15.186095     1  2492  2493
2493  2492  H      0.432564  -22.733709   14.472105     2  2491
2494  2493  H     -0.418918  -23.943530   14.793367     2  2491
2495  2494  O    -31.304718   -4.855967   16.244272     1  2495  2496
2496  2495  H    -30.765847   -5.018823   15.470110     2  2494
2497  2496  H    -31.239342   -3.911865   16.387901     2  2494
2498  2497  O     -2.996453  -12.007989    6.965602     1  2498  2499
2499  2498  H     -3.681084  -11.456575    6.586847     2  2497
2500  2499  H     -2.652936  -11.495428    7.697386     2  2497
2501  2500  O     26.616947    2.135860  -19.525395     1  2501  2502
2502  2501  H     26.414502    1.239266  -19.258248     2  2500
2503  2502  H     27.357748    2.388924  -18.974573     2  2500
2504  2503  O    -27.455303   -5.384113   -5.928785     1  2504  2505
2505  2504  H    -26.685280   -5.466410   -6.491389     2  2503
2506  2505  H    -27.983967   -6.155994   -6.131138     2  2503
2507  2506  O    -20.511981  -23.716936   -0.338001     1  2507  2508
2508  2507  H    -20.691201  -22.840100    0.001516     2  2506
2509  2508  H    -20.383080  -24.255013    0.443081     2  2506
2510  2509  O     19.193361   28.423524    1.675675     1  2510  2511
2511  2510  H     19.213450   29.257828    1.206885     2  2509
2512  2511  H     18.809280   28.635470    2.526435     2  2509
2513  2512  O    -30.941022   -7.258023    5.497986     1  2513  2514
2514  2513  H    -30.407478   -8.042902    5.373380     2  2512
2515  2514  H    -31.782630   -7.473668    5.096209     2  2512
2516  2515  O    -19.037960   -9.108278    9.761909     1  2516  2517
2517  2516  H    -19.043647   -8.159948    9.632026     2  2515
2518  2517  H    -19.380204   -9.464832    8.942171     2  2515
2519  2518  O    -23.416838  -23.014173    7.196180     1  2519  2520
2520  2519  H    -23.590085  -23.702525    6.554006     2  2518
2521  2520  H    -23.010819  -22.310462    6.690046     2  2518
2522  2521  O    -20.973979  -17.158489    3.693097     1  2522  2523
2523  2522  H    -21.340153  -16.304981    3.461424     2  2521
2524  2523  H    -20.391834  -16.977566    4.431071     2  2521
2525  2524  O     -6.020606  -24.448727   23.065986     1  2525  2526
2526  2525  H     -6.659410  -23.745123   23.180446     2  2524
2527  2526  H     -5.515264  -24.190987   22.294992     2  2524
2528  2527  O     -0.253483  -15.748832   28.145186     1  2528  2529
2529  2528  H     -0.784132  -15.997111   28.902155     2  2527
2530  2529  H     -0.652854  -14.939072   27.827345     2  2527
2531  2530  O    -17.841342  -12.337303   15.454876     1  2531  2532
2532  2531  H    -17.211469  -12.281878   14.736253     2  2530
2533  2532  H    -18.341809  -13.133060   15.274503     2  2530
2534  2533  O    -25.210736  -23.386702    1.758339     1  2534  2535
2535  2534  H    -24.321240  -23.147449    2.018696     2  2533
2536  2535  H    -25.141920  -24.300013    1.480204     2  2533
2537  2536  O      4.685426   26.165738  -20.912545     1  2537  2538
2538  2537  H      5.531619   25.810502  -21.184566     2  2536
2539  2538  H      4.547255   26.920979  -21.484167     2  2536
2540  2539  O     -3.140078  -12.352882   34.399005     1  2540  2541
2541  2540  H     -2.308435  -12.125074   34.814583     2  2539
2542  2541  H     -3.561053  -11.510612   34.226978     2  2539
2543  2542  O    -19.619808  -13.985071   12.287127     1  2543  2544
2544  2543  H    -20.397354  -13.461920   12.092276     2  2542
2545  2544  H    -19.764746  -14.308399   13.176331     2  2542
2546  2545  O     -3.388690   -2.890989   11.743635     1  2546  2547
2547  2546  H     -2.957565   -3.445980   12.393519     2  2545
2548  2547  H     -3.476672   -2.040817   12.174565     2  2545
2549  2548  O    -12.961576   -7.617194   12.806385     1  2549  2550
2550  2549  H    -12.643979   -7.141583   12.038818     2  2548
2551  2550  H    -12.519393   -7.201172   13.546407     2  2548
2552  2551  O     16.286825   28.199848   -9.524763     1  2552  2553
2553  2552  H     16.051250   28.122274   -8.600254     2  2551
2554  2553  H     15.989709   27.379195   -9.917805     2  2551
2555  2554  O    -16.440794  -20.345224    4.829639     1  2555  2556
2556  2555  H    -16.428142  -20.889550    4.042377     2  2554
2557  2556  H    -17.241570  -20.602608    5.286522     2  2554
2558  2557  O    -15.422801   -5.355401    3.762132     1  2558  2559
2559  2558  H    -14.980172   -5.173525    2.933138     2  2557
2560  2559  H    -15.448804   -4.510251    4.210770     2  2557
2561  2560  O     -6.403861  -23.337627   13.096678     1  2561  2562
2562  2561  H     -6.470644  -24.249934   13.378576     2  2560
2563  2562  H     -6.444976  -23.378052   12.141216     2  2560
2564  2563  O    -10.913050  -21.892107   11.444052     1  2564  2565
2565  2564  H    -11.693886  -22.295314   11.064645     2  2563
2566  2565  H    -11.069442  -21.907994   12.388256     2  2563
2567  2566  O    -22.336155  -15.158053    9.939620     1  2567  2568
2568  2567  H    -21.892662  -14.405282   10.330622     2  2566
2569  2568  H    -23.267047  -14.991981   10.088248     2  2566
2570  2569  O    -28.988675    3.763205   13.774135     1  2570  2571
2571  2570  H    -29.758602    4.108341   14.226158     2  2569
2572  2571  H    -28.260098    4.287478   14.106617     2  2569
2573  2572  O    -22.562087  -16.015052   -2.608895     1  2573  2574
2574  2573  H    -23.518230  -16.024174   -2.652911     2  2572
2575  2574  H    -22.347758  -15.166328   -2.221646     2  2572
2576  2575  O     26.581263   15.454732   -7.915001     1  2576  2577
2577  2576  H     26.369565   14.565520   -7.630893     2  2575
2578  2577  H     27.058255   15.337037   -8.736498     2  2575
2579  2578  O    -18.345836    5.350496   29.469823     1  2579  2580
2580  2579  H    -19.042155    5.946367   29.193582     2  2578
2581  2580  H    -18.725337    4.477001   29.373821     2  2578
2582  2581  O     -9.494405    0.762205    6.730958     1  2582  2583
2583  2582  H    -10.415491    0.608785    6.941416     2  2581
2584  2583  H     -9.037071    0.658508    7.565418     2  2581
2585  2584  O    -34.005182   -4.331516   -5.494860     1  2585  2586
2586  2585  H    -33.115105   -4.265627   -5.148950     2  2584
2587  2586  H    -33.893650   -4.333631   -6.445537     2  2584
2588  2587  O    -21.525838   -2.529639   26.820783     1  2588  2589
2589  2588  H    -20.834304   -3.055076   27.223186     2  2587
2590  2589  H    -21.502685   -2.771113   25.894832     2  2587
2591  2590  O     19.173817   14.013738  -18.073631     1  2591  2592
2592  2591  H     18.764822   13.677153  -18.870917     2  2590
2593  2592  H     19.293530   14.948464  -18.241527     2  2590
2594  2593  O    -12.436040  -27.833847    0.850846     1  2594  2595
2595  2594  H    -13.210116  -28.108020    0.359046     2  2593
2596  2595  H    -11.777731  -28.500018    0.653165     2  2593
2597  2596  O     -1.042127   -2.187084   18.051299     1  2597  2598
2598  2597  H     -1.315265   -2.528035   17.199607     2  2596
2599  2598  H     -1.600692   -1.423021   18.194277     2  2596
2600  2599  O     -0.226288  -29.970364    8.707709     1  2600  2601
2601  2600  H      0.370665  -29.516189    8.113063     2  2599
2602  2601  H      0.047331  -30.886796    8.668750     2  2599
2603  2602  O     -0.548320   -6.551583   23.215850     1  2603  2604
2604  2603  H     -1.030663   -5.959905   22.638360     2  2602
2605  2604  H      0.181370   -6.865974   22.682051     2  2602
2606  2605  O     -2.176244   -3.443979    9.048828     1  2606  2607
2607  2606  H     -2.380422   -3.045265    9.894741     2  2605
2608  2607  H     -1.241904   -3.646017    9.098017     2  2605
2609  2608  O    -11.236999   -9.220374    0.927244     1  2609  2610
2610  2609  H    -10.567985   -8.646133    0.554553     2  2608
2611  2610  H    -11.856062   -8.624976    1.349729     2  2608
2612  2611  O    -20.291077   -5.953544   15.938386     1  2612  2613
2613  2612  H    -20.719614   -6.312966   15.161595     2  2611
2614  2613  H    -19.599542   -6.582708   16.143721     2  2611
2615  2614  O    -11.977880  -24.358769    9.930168     1  2615  2616
2616  2615  H    -12.546109  -24.662136   10.638205     2  2614
2617  2616  H    -12.521461  -23.749618    9.430480     2  2614
2618  2617  O    -33.776440   -4.095578    3.508729     1  2618  2619
2619  2618  H    -33.972124   -4.706598    4.219076     2  2617
2620  2619  H    -34.631318   -3.761090    3.237561     2  2617
2621  2620  O    -13.679918   -5.826246   17.052159     1  2621  2622
2622  2621  H    -14.122341   -6.657214   16.878994     2  2620
2623  2622  H    -12.860036   -6.075233   17.478810     2  2620
2624  2623  O      1.570513  -16.723299    3.198302     1  2624  2625
2625  2624  H      0.952641  -16.003824    3.068601     2  2623
2626  2625  H      2.309024  -16.325277    3.659183     2  2623
2627  2626  O     -7.355667  -12.864802   27.242052     1  2627  2628
2628  2627  H     -6.863885  -13.118364   28.023133     2  2626
2629  2628  H     -8.272666  -12.997949   27.482087     2  2626
2630  2629  O     -9.186637  -26.055120    1.962877     1  2630  2631
2631  2630  H     -9.099335  -26.333630    1.051262     2  2629
2632  2631  H    -10.116349  -25.850763    2.063396     2  2629
2633  2632  O    -21.642805  -26.025525    3.270363     1  2633  2634
2634  2633  H    -22.275715  -26.623124    2.872201     2  2632
2635  2634  H    -22.131266  -25.588659    3.968063     2  2632
2636  2635  O    -30.592833   -5.620966    8.126943     1  2636  2637
2637  2636  H    -29.689818   -5.932553    8.066041     2  2635
2638  2637  H    -31.019140   -5.965859    7.342378     2  2635
2639  2638  O     -1.964055    1.131068   21.796831     1  2639  2640
2640  2639  H     -1.605595    1.168361   22.683594     2  2638
2641  2640  H     -2.843845    1.499340   21.877935     2  2638
2642  2641  O     11.080112    5.477785   34.577271     1  2642  2643
2643  2642  H     11.931285    5.225042   34.934841     2  2641
2644  2643  H     11.265956    6.243344   34.033568     2  2641
2645  2644  O    -16.157177   -6.062205   24.452361     1  2645  2646
2646  2645  H    -16.164025   -5.321499   25.058610     2  2644
2647  2646  H    -15.860565   -5.689895   23.621916     2  2644
2648  2647  O    -13.834387   -6.755075    9.128558     1  2648  2649
2649  2648  H    -13.058676   -6.632178    9.675732     2  2647
2650  2649  H    -13.490680   -6.830308    8.238369     2  2647
2651  2650  O    -14.364906   -3.776931   22.730921     1  2651  2652
2652  2651  H    -13.746408   -3.366751   23.335439     2  2650
2653  2652  H    -14.112536   -4.700188   22.719168     2  2650
2654  2653  O    -18.603585  -21.505684    6.376848     1  2654  2655
2655  2654  H    -19.019504  -21.112146    7.143901     2  2653
2656  2655  H    -18.224929  -22.322549    6.701783     2  2653
2657  2656  O     32.392647   -7.028800   -1.666340     1  2657  2658
2658  2657  H     31.846251   -7.436918   -2.337996     2  2656
2659  2658  H     32.912622   -6.380488   -2.141261     2  2656
2660  2659  O     -7.477479  -14.307012    5.080694     1  2660  2661
2661  2660  H     -7.010552  -13.720121    4.485909     2  2659
2662  2661  H     -7.165208  -15.181676    4.848999     2  2659
2663  2662  O    -21.983255   -4.607814   19.128407     1  2663  2664
2664  2663  H    -21.427883   -3.841644   19.272549     2  2662
2665  2664  H    -21.580001   -5.298808   19.653901     2  2662
2666  2665  O    -13.823918  -21.385176   16.533550     1  2666  2667
2667  2666  H    -14.618755  -21.033880   16.132232     2  2665
2668  2667  H    -13.229598  -20.636543   16.584184     2  2665
2669  2668  O    -11.815708   -9.919204    8.383426     1  2669  2670
2670  2669  H    -11.523268  -10.549722    9.041572     2  2668
2671  2670  H    -12.223990   -9.216446    8.889063     2  2668
2672  2671  O     -8.100867  -21.575801   19.590604     1  2672  2673
2673  2672  H     -8.828097  -20.990936   19.377762     2  2671
2674  2673  H     -7.361886  -21.232493   19.088332     2  2671
2675  2674  O     -3.635348  -11.437961   19.701976     1  2675  2676
2676  2675  H     -3.409963  -11.984704   18.949310     2  2674
2677  2676  H     -2.836861  -10.943657   19.887217     2  2674
2678  2677  O    -12.557044  -28.985823    9.097365     1  2678  2679
2679  2678  H    -13.273262  -28.362382    8.976594     2  2677
2680  2679  H    -11.994580  -28.856035    8.333806     2  2677
2681  2680  O    -24.763005   -8.577573   21.227198     1  2681  2682
2682  2681  H    -24.426587   -9.440339   20.984939     2  2680
2683  2682  H    -24.440409   -7.992949   20.541358     2  2680
2684  2683  O    -30.972276   -8.901610   13.178187     1  2684  2685
2685  2684  H    -30.948065   -9.564475   12.488074     2  2683
2686  2685  H    -30.073290   -8.577154   13.230948     2  2683
2687  2686  O      0.481884  -12.699207   21.555304     1  2687  2688
2688  2687  H      0.908340  -12.560713   20.709617     2  2686
2689  2688  H      1.155308  -13.107035   22.099737     2  2686
2690  2689  O    -29.426402  -18.774299   -2.216717     1  2690  2691
2691  2690  H    -29.724627  -18.340976   -1.417015     2  2689
2692  2691  H    -30.141791  -18.646892   -2.839789     2  2689
2693  2692  O    -30.247199   -4.549504    0.609537     1  2693  2694
2694  2693  H    -31.031514   -4.656657    1.147682     2  2692
2695  2694  H    -30.057889   -3.611892    0.645273     2  2692
2696  2695  O     -5.953163  -23.587128   10.200581     1  2696  2697
2697  2696  H     -5.171496  -24.015531    9.851726     2  2695
2698  2697  H     -6.380133  -23.205421    9.433621     2  2695
2699  2698  O     -2.383510    2.218038    8.227813     1  2699  2700
2700  2699  H     -1.627415    2.803064    8.179893     2  2698
2701  2700  H     -2.920219    2.576913    8.934483     2  2698
2702  2701  O    -25.035558   -5.301695    1.843448     1  2702  2703
2703  2702  H    -25.312635   -4.418292    2.086467     2  2701
2704  2703  H    -25.275784   -5.843792    2.594882     2  2701
2705  2704  O     -4.285622   -3.431314    2.711089     1  2705  2706
2706  2705  H     -4.231905   -4.280470    3.149586     2  2704
2707  2706  H     -3.549369   -3.430086    2.099402     2  2704
2708  2707  O    -31.979314   -1.971779   12.957519     1  2708  2709
2709  2708  H    -31.048040   -2.088841   13.145291     2  2707
2710  2709  H    -32.006750   -1.698546   12.040555     2  2707
2711  2710  O    -17.966016  -13.359035   19.011108     1  2711  2712
2712  2711  H    -18.608878  -14.040664   18.815298     2  2710
2713  2712  H    -18.134420  -12.676562   18.361414     2  2710
2714  2713  O     -8.576529   -2.104723    3.609778     1  2714  2715
2715  2714  H     -8.003127   -2.423294    2.912674     2  2713
2716  2715  H     -9.441975   -2.053549    3.204050     2  2713
2717  2716  O      7.873087   22.089690  -22.031047     1  2717  2718
2718  2717  H      8.243029   21.291219  -22.407634     2  2716
2719  2718  H      7.208446   21.779400  -21.416064     2  2716
2720  2719  O    -29.405397   20.841512   -3.839738     1  2720  2721
2721  2720  H    -28.745651   20.148324   -3.818350     2  2719
2722  2721  H    -28.928476   21.617756   -4.133373     2  2719
2723  2722  O     -3.052312  -36.089753    7.386495     1  2723  2724
2724  2723  H     -2.912316  -35.680410    8.240351     2  2722
2725  2724  H     -3.419840  -36.949824    7.590042     2  2722
2726  2725  O    -28.434954   -8.381327    9.982241     1  2726  2727
2727  2726  H    -28.357974   -7.725186    9.289576     2  2725
2728  2727  H    -27.616615   -8.875754    9.936473     2  2725
2729  2728  O    -16.840111  -23.910392    4.295854     1  2729  2730
2730  2729  H    -17.366168  -24.694361    4.138092     2  2728
2731  2730  H    -16.990930  -23.701696    5.217771     2  2728
2732  2731  O    -18.804079   -9.526542   -3.409687     1  2732  2733
2733  2732  H    -18.554998   -9.841508   -4.278587     2  2731
2734  2733  H    -18.282572   -8.733923   -3.283130     2  2731
2735  2734  O    -11.996481  -25.847624   15.429005     1  2735  2736
2736  2735  H    -11.638468  -25.034684   15.072372     2  2734
2737  2736  H    -11.316951  -26.169633   16.021273     2  2734
2738  2737  O    -34.836007   -3.668616    0.424421     1  2738  2739
2739  2738  H    -34.139143   -4.323136    0.377353     2  2737
2740  2739  H    -35.244907   -3.814350    1.277530     2  2737
2741  2740  O     -8.888802   -0.632327   31.735022     1  2741  2742
2742  2741  H     -9.462922   -0.035912   31.254494     2  2740
2743  2742  H     -8.616554   -0.134375   32.505838     2  2740
2744  2743  O     -7.094645  -17.559566    7.990913     1  2744  2745
2745  2744  H     -6.899912  -16.661351    7.723482     2  2743
2746  2745  H     -6.262612  -17.896870    8.322844     2  2743
2747  2746  O    -32.605078    1.466863   11.853935     1  2747  2748
2748  2747  H    -31.647969    1.454280   11.849996     2  2746
2749  2748  H    -32.835777    1.921491   12.664073     2  2746
2750  2749  O     -4.379492  -21.786825   21.875473     1  2750  2751
2751  2750  H     -4.969758  -21.761299   22.628578     2  2749
2752  2751  H     -3.511021  -21.919042   22.255616     2  2749
2753  2752  O    -24.240135   -8.650765   12.264672     1  2753  2754
2754  2753  H    -23.995881   -8.073197   12.987850     2  2752
2755  2754  H    -24.026130   -8.151867   11.476297     2  2752
2756  2755  O     13.979486   16.267662  -22.482756     1  2756  2757
2757  2756  H     13.456834   15.610041  -22.023842     2  2755
2758  2757  H     13.335356   16.875492  -22.845896     2  2755
2759  2758  O     -6.766049  -10.807356    3.877494     1  2759  2760
2760  2759  H     -7.101360  -10.122469    3.298937     2  2758
2761  2760  H     -6.847658  -11.613376    3.367687     2  2758
2762  2761  O    -24.179357  -17.431491    2.271476     1  2762  2763
2763  2762  H    -23.493140  -17.792480    2.832746     2  2761
2764  2763  H    -24.823183  -17.071002    2.881203     2  2761
2765  2764  O    -29.240514   -5.175918    5.070374     1  2765  2766
2766  2765  H    -29.808642   -5.917563    5.278761     2  2764
2767  2766  H    -29.018162   -4.797497    5.921015     2  2764
2768  2767  O    -15.102011  -14.476067   12.974935     1  2768  2769
2769  2768  H    -15.432095  -13.610197   13.214820     2  2767
2770  2769  H    -14.974223  -14.430148   12.027415     2  2767
2771  2770  O     -5.690872  -19.654616   20.493196     1  2771  2772
2772  2771  H     -5.357629  -20.471418   20.864699     2  2770
2773  2772  H     -6.476307  -19.461075   21.004925     2  2770
2774  2773  O      2.807112    1.648352    9.408220     1  2774  2775
2775  2774  H      2.103304    1.890699   10.010012     2  2773
2776  2775  H      3.465108    2.334532    9.519709     2  2773
2777  2776  O    -20.946875   -5.440189   21.588529     1  2777  2778
2778  2777  H    -21.309489   -6.325044   21.630659     2  2776
2779  2778  H    -20.126041   -5.539916   21.106329     2  2776
2780  2779  O     -0.706219  -21.551190   17.188131     1  2780  2781
2781  2780  H     -0.850345  -22.181886   17.893596     2  2779
2782  2781  H     -0.324006  -22.067808   16.478729     2  2779
2783  2782  O    -20.937332  -23.505872    5.230109     1  2783  2784
2784  2783  H    -20.130973  -23.019284    5.059089     2  2782
2785  2784  H    -20.764409  -23.978322    6.044431     2  2782
2786  2785  O    -33.469130    1.159636    0.790909     1  2786  2787
2787  2786  H    -32.670240    1.640798    0.575298     2  2785
2788  2787  H    -33.316880    0.277521    0.451903     2  2785
2789  2788  O     -6.858065  -16.970290   11.118915     1  2789  2790
2790  2789  H     -6.824430  -17.721113   11.711676     2  2788
2791  2790  H     -7.737025  -16.610233   11.237321     2  2788
2792  2791  O    -27.779016   -6.407860    7.815763     1  2792  2793
2793  2792  H    -27.151238   -6.736577    7.172278     2  2791
2794  2793  H    -27.337345   -5.662639    8.222952     2  2791
2795  2794  O    -15.474337  -24.507469    0.301035     1  2795  2796
2796  2795  H    -14.743166  -25.010837    0.659143     2  2794
2797  2796  H    -15.100464  -23.648809    0.103162     2  2794
2798  2797  O     -2.197614  -28.199203   -0.237123     1  2798  2799
2799  2798  H     -2.711120  -29.006748   -0.216787     2  2797
2800  2799  H     -2.723462  -27.567993    0.254089     2  2797
2801  2800  O    -24.608775  -24.578753    5.288080     1  2801  2802
2802  2801  H    -24.190835  -24.025754    4.627966     2  2800
2803  2802  H    -24.948211  -25.325861    4.795288     2  2800
2804  2803  O     -3.601936   -9.270769   -0.112634     1  2804  2805
2805  2804  H     -2.932973   -9.911062   -0.355005     2  2803
2806  2805  H     -3.590784   -9.262642    0.844466     2  2803
2807  2806  O    -20.945704  -10.394074   16.134607     1  2807  2808
2808  2807  H    -21.856002  -10.516099   15.864980     2  2806
2809  2808  H    -20.470141  -10.251075   15.316302     2  2806
2810  2809  O    -30.278271   -4.342649   10.500092     1  2810  2811
2811  2810  H    -30.171399   -4.775557    9.653097     2  2809
2812  2811  H    -30.940493   -4.863774   10.954099     2  2809
2813  2812  O      2.629049   -9.041947   14.252375     1  2813  2814
2814  2813  H      3.196274   -8.709853   14.948220     2  2812
2815  2814  H      3.215628   -9.536721   13.680226     2  2812
2816  2815  O    -11.654846   -7.592524    4.521842     1  2816  2817
2817  2816  H    -12.207635   -7.389707    5.276509     2  2815
2818  2817  H    -11.685670   -8.546622    4.451284     2  2815
2819  2818  O     -7.462020   -4.195977   27.149322     1  2819  2820
2820  2819  H     -6.608764   -3.764789   27.196886     2  2818
2821  2820  H     -7.258492   -5.131287   27.147588     2  2818
2822  2821  O    -14.115649  -23.992697   15.093081     1  2822  2823
2823  2822  H    -13.708563  -24.765161   15.485270     2  2821
2824  2823  H    -13.664465  -23.251956   15.498010     2  2821
2825  2824  O      1.572805  -27.844775   12.608679     1  2825  2826
2826  2825  H      0.622781  -27.790669   12.504960     2  2824
2827  2826  H      1.779731  -27.186134   13.271706     2  2824
2828  2827  O     -1.330811  -15.477663   23.903443     1  2828  2829
2829  2828  H     -1.933172  -14.998039   23.334801     2  2827
2830  2829  H     -1.018651  -14.823433   24.528560     2  2827
2831  2830  O    -22.503172   -6.923008   -6.256601     1  2831  2832
2832  2831  H    -22.544915   -6.357399   -7.027687     2  2830
2833  2832  H    -23.164730   -6.568286   -5.662678     2  2830
2834  2833  O    -13.206069   -6.330141   23.260519     1  2834  2835
2835  2834  H    -13.737929   -7.117391   23.143925     2  2833
2836  2835  H    -12.474931   -6.613595   23.809448     2  2833
2837  2836  O    -29.468763   -2.167279   13.960288     1  2837  2838
2838  2837  H    -29.298689   -3.076137   13.712734     2  2836
2839  2838  H    -28.638695   -1.857992   14.323001     2  2836
2840  2839  O    -21.475662  -19.001832    1.693072     1  2840  2841
2841  2840  H    -21.453309  -18.439547    2.467389     2  2839
2842  2841  H    -21.332087  -18.404850    0.958749     2  2839
2843  2842  O    -14.853130   -8.912159    6.527866     1  2843  2844
2844  2843  H    -15.808885   -8.912433    6.475294     2  2842
2845  2844  H    -14.655963   -9.418994    7.315568     2  2842
2846  2845  O    -27.399070   -1.689424   15.694718     1  2846  2847
2847  2846  H    -27.290970   -1.684989   16.645784     2  2845
2848  2847  H    -26.756359   -1.055138   15.377173     2  2845
2849  2848  O    -17.615926  -30.693428    2.028959     1  2849  2850
2850  2849  H    -17.642588  -30.672991    1.072349     2  2848
2851  2850  H    -16.689965  -30.811619    2.240762     2  2848
2852  2851  O    -23.427626  -17.949619    4.888504     1  2852  2853
2853  2852  H    -22.611341  -17.595830    4.535314     2  2851
2854  2853  H    -23.810588  -17.223661    5.381004     2  2851
2855  2854  O     -9.415611  -10.730821   21.869868     1  2855  2856
2856  2855  H     -9.066940  -11.545942   21.508982     2  2854
2857  2856  H     -8.716896  -10.400029   22.434319     2  2854
2858  2857  O    -13.292956  -20.458266    6.049133     1  2858  2859
2859  2858  H    -13.030477  -20.969607    6.814553     2  2857
2860  2859  H    -14.194199  -20.730471    5.876224     2  2857
2861  2860  O    -27.839856   -0.961378   10.427432     1  2861  2862
2862  2861  H    -27.702237   -0.311179   11.116296     2  2860
2863  2862  H    -28.206939   -0.463248    9.697125     2  2860
2864  2863  O    -14.435706  -20.552725    9.295204     1  2864  2865
2865  2864  H    -14.547174  -19.794159    9.868252     2  2863
2866  2865  H    -13.605604  -20.394058    8.845773     2  2863
2867  2866  O     -0.312959  -15.166357   11.950692     1  2867  2868
2868  2867  H     -0.895544  -14.508699   12.330577     2  2866
2869  2868  H     -0.420069  -15.934546   12.511625     2  2866
2870  2869  O    -23.342121  -18.798291   11.157508     1  2870  2871
2871  2870  H    -23.322173  -18.567248   10.228825     2  2869
2872  2871  H    -22.434183  -18.707934   11.446846     2  2869
2873  2872  O    -20.542259    3.339366   25.511528     1  2873  2874
2874  2873  H    -21.207941    2.653654   25.457703     2  2872
2875  2874  H    -20.305332    3.515830   24.601057     2  2872
2876  2875  O     -7.353121  -14.577991   15.334943     1  2876  2877
2877  2876  H     -6.615595  -14.182077   14.870681     2  2875
2878  2877  H     -6.957997  -15.265354   15.871265     2  2875
2879  2878  O     17.816249   19.826048  -15.211543     1  2879  2880
2880  2879  H     18.132490   19.070706  -15.707205     2  2878
2881  2880  H     16.864570   19.796182  -15.309765     2  2878
2882  2881  O    -20.464836  -23.172407    9.801361     1  2882  2883
2883  2882  H    -20.175213  -22.277176    9.625543     2  2881
2884  2883  H    -19.827988  -23.511502   10.430384     2  2881
2885  2884  O    -11.553609   -3.607550   20.696557     1  2885  2886
2886  2885  H    -11.181205   -3.804908   21.555974     2  2884
2887  2886  H    -12.296728   -4.205207   20.614028     2  2884
2888  2887  O      2.371665  -27.240168    9.717822     1  2888  2889
2889  2888  H      2.616626  -27.816339   10.441875     2  2887
2890  2889  H      1.428363  -27.113914    9.820163     2  2887
2891  2890  O     -2.053875  -29.882616   15.685366     1  2891  2892
2892  2891  H     -1.274454  -30.229274   15.251127     2  2890
2893  2892  H     -2.596508  -30.652656   15.855128     2  2890
2894  2893  O    -30.913425    0.366919   19.498846     1  2894  2895
2895  2894  H    -30.882285    0.771344   20.365854     2  2893
2896  2895  H    -31.595531   -0.300852   19.569881     2  2893
2897  2896  O    -26.750236   -4.577583    9.434612     1  2897  2898
2898  2897  H    -27.282566   -4.514555   10.227634     2  2896
2899  2898  H    -26.306773   -3.731378    9.375369     2  2896
2900  2899  O     27.658858   20.785801   -5.979219     1  2900  2901
2901  2900  H     26.737312   20.548817   -6.083245     2  2899
2902  2901  H     27.779260   20.871815   -5.033526     2  2899
2903  2902  O    -11.309697  -22.650546    0.458970     1  2903  2904
2904  2903  H    -10.596510  -22.204481    0.915721     2  2902
2905  2904  H    -11.146440  -22.477228   -0.468144     2  2902
2906  2905  O     -3.576983  -14.695399   -2.792300     1  2906  2907
2907  2906  H     -2.640892  -14.888667   -2.741192     2  2905
2908  2907  H     -3.785568  -14.763472   -3.724013     2  2905
2909  2908  O      1.489241   27.491918  -22.521016     1  2909  2910
2910  2909  H      1.842086   27.721094  -23.380789     2  2908
2911  2910  H      1.257969   28.332018  -22.124814     2  2908
2912  2911  O    -23.640767   -0.682316   19.120452     1  2912  2913
2913  2912  H    -24.393154   -0.489648   19.679940     2  2911
2914  2913  H    -22.970869   -1.006563   19.722393     2  2911
2915  2914  O    -19.686848  -14.582083   15.230395     1  2915  2916
2916  2915  H    -19.313701  -15.452081   15.088631     2  2914
2917  2916  H    -20.575166  -14.750274   15.544775     2  2914
2918  2917  O    -28.611244  -14.089801    7.039115     1  2918  2919
2919  2918  H    -29.216006  -14.349934    7.733972     2  2917
2920  2919  H    -29.177330  -13.853277    6.304381     2  2917
2921  2920  O     -6.567281   -4.838159   30.206352     1  2921  2922
2922  2921  H     -7.440386   -5.145599   29.962632     2  2920
2923  2922  H     -6.720474   -3.996852   30.636430     2  2920
2924  2923  O    -16.863209  -10.371020   19.536950     1  2924  2925
2925  2924  H    -17.540189  -10.558399   18.886704     2  2923
2926  2925  H    -17.323040   -9.903492   20.234235     2  2923
2927  2926  O     -1.686280  -16.245622   30.271422     1  2927  2928
2928  2927  H     -1.437123  -17.065412   30.698150     2  2926
2929  2928  H     -2.462148  -15.952484   30.749261     2  2926
2930  2929  O     -3.532003  -18.024662   21.094444     1  2930  2931
2931  2930  H     -4.184859  -18.553456   20.635765     2  2929
2932  2931  H     -3.242091  -18.577560   21.820038     2  2929
2933  2932  O    -21.611260   -9.974202   11.122003     1  2933  2934
2934  2933  H    -20.833975   -9.723915   10.622588     2  2932
2935  2934  H    -22.314387   -9.437105   10.756803     2  2932
2936  2935  O     22.891442    8.661259  -22.422192     1  2936  2937
2937  2936  H     23.276232    9.485157  -22.123262     2  2935
2938  2937  H     22.998532    8.063868  -21.681998     2  2935
2939  2938  O    -29.496242  -16.651016    0.400560     1  2939  2940
2940  2939  H    -30.292687  -16.472576   -0.099507     2  2938
2941  2940  H    -29.463850  -15.954878    1.056742     2  2938
2942  2941  O    -26.262384  -13.397353    5.525102     1  2942  2943
2943  2942  H    -26.494486  -13.685582    4.642331     2  2941
2944  2943  H    -27.035935  -13.594805    6.053177     2  2941
2945  2944  O      2.167705  -11.925390   19.690112     1  2945  2946
2946  2945  H      2.268311  -12.793090   19.298696     2  2944
2947  2946  H      2.863472  -11.875665   20.345601     2  2944
2948  2947  O     -6.533282   -7.450030   26.077149     1  2948  2949
2949  2948  H     -7.102527   -7.385491   25.310320     2  2947
2950  2949  H     -6.974020   -8.076520   26.651163     2  2947
2951  2950  O    -10.041703   -3.124486   31.215213     1  2951  2952
2952  2951  H    -10.520858   -2.337829   30.954805     2  2950
2953  2952  H     -9.180735   -2.803357   31.483246     2  2950
2954  2953  O      0.818463  -23.788255    9.499767     1  2954  2955
2955  2954  H      0.137076  -23.203975    9.832272     2  2953
2956  2955  H      0.349046  -24.416595    8.951071     2  2953
2957  2956  O    -36.248131   -3.371426    2.994028     1  2957  2958
2958  2957  H    -36.657800   -2.568574    2.671802     2  2956
2959  2958  H    -36.968717   -3.871306    3.377574     2  2956
2960  2959  O     -4.922772  -10.116072    5.738267     1  2960  2961
2961  2960  H     -5.478378   -9.593478    6.316565     2  2959
2962  2961  H     -5.495563  -10.360056    5.011208     2  2959
2963  2962  O     -2.282407  -24.183762    7.002458     1  2963  2964
2964  2963  H     -2.317255  -23.556569    7.724708     2  2962
2965  2964  H     -1.452579  -23.997914    6.563052     2  2962
2966  2965  O    -21.651158  -28.380874   -0.193274     1  2966  2967
2967  2966  H    -22.083051  -28.264013    0.652919     2  2965
2968  2967  H    -20.831699  -28.829376    0.015442     2  2965
2969  2968  O    -17.915412   -4.348660   14.023948     1  2969  2970
2970  2969  H    -17.716071   -5.071924   14.618409     2  2968
2971  2970  H    -17.113715   -4.228428   13.514970     2  2968
2972  2971  O    -25.226966   -2.296025   13.473112     1  2972  2973
2973  2972  H    -24.448202   -2.851851   13.444558     2  2971
2974  2973  H    -25.097631   -1.741036   14.242197     2  2971
2975  2974  O     -5.727270   -6.008908   32.807618     1  2975  2976
2976  2975  H     -4.951456   -5.682848   32.351514     2  2974
2977  2976  H     -6.464061   -5.622686   32.334117     2  2974
2978  2977  O    -33.296358   -7.613892    7.602626     1  2978  2979
2979  2978  H    -32.753863   -7.798650    8.369303     2  2977
2980  2979  H    -33.118985   -8.338505    7.002871     2  2977
2981  2980  O    -19.612569  -16.078969    1.070719     1  2981  2982
2982  2981  H    -20.504772  -16.270894    0.781983     2  2980
2983  2982  H    -19.225962  -16.937620    1.242434     2  2980
2984  2983  O     -5.434310  -25.724313    2.788228     1  2984  2985
2985  2984  H     -6.291591  -25.474269    3.132871     2  2983
2986  2985  H     -4.809788  -25.218483    3.308171     2  2983
2987  2986  O    -14.940162   -0.834496   28.549283     1  2987  2988
2988  2987  H    -15.832300   -0.522166   28.398378     2  2986
2989  2988  H    -14.951144   -1.167861   29.446489     2  2986
2990  2989  O    -25.445995   -2.296522    8.512372     1  2990  2991
2991  2990  H    -25.707554   -2.235065    7.593654     2  2989
2992  2991  H    -25.328519   -1.387955    8.789744     2  2989
2993  2992  O     -6.564967  -16.713553   24.450327     1  2993  2994
2994  2993  H     -5.839432  -16.794995   25.069356     2  2992
2995  2994  H     -6.498283  -17.492865   23.898549     2  2992
2996  2995  O     29.920489   -0.626163   -4.980577     1  2996  2997
2997  2996  H     29.263728   -0.451842   -4.306405     2  2995
2998  2997  H     29.436118   -1.065499   -5.679577     2  2995
2999  2998  O     -0.917605   -0.042196   -5.186212     1  2999  3000
3000  2999  H     -0.761985    0.876079   -5.407083     2  2998
3001  3000  H     -0.385967   -0.533154   -5.812753     2  2998
3002  3001  O    -19.440807    0.438988   30.069746     1  3002  3003
3003  3002  H    -20.196066    0.362533   30.652816     2  3001
3004  3003  H    -18.930382   -0.354152   30.232928     2  3001
3005  3004  O    -11.873834  -11.190198   11.142722     1  3005  3006
3006  3005  H    -12.726605  -10.849109   11.412300     2  3004
3007  3006  H    -12.040124  -12.107354   10.925000     2  3004
3008  3007  O     -6.657016    4.697001   13.886549     1  3008  3009
3009  3008  H     -6.524890    5.096785   14.746169     2  3007
3010  3009  H     -6.574646    5.423507   13.268782     2  3007
3011  3010  O    -10.683761  -19.066479   11.517892     1  3011  3012
3012  3011  H     -9.807182  -19.168320   11.888659     2  3010
3013  3012  H    -10.910039  -19.938270   11.193837     2  3010
3014  3013  O    -18.651323  -10.988400   17.716654     1  3014  3015
3015  3014  H    -19.596181  -10.945112   17.569679     2  3013
3016  3015  H    -18.300723  -11.371895   16.912762     2  3013
3017  3016  O     28.742199    6.962865   -3.947073     1  3017  3018
3018  3017  H     28.273155    6.844694   -3.121080     2  3016
3019  3018  H     28.533670    7.857656   -4.215582     2  3016
3020  3019  O     -5.937499   33.888553   14.548317     1  3020  3021
3021  3020  H     -5.551855   33.012628   14.564590     2  3019
3022  3021  H     -5.187090   34.480153   14.492406     2  3019
3023  3022  O     -5.219688   -8.930674   10.478564     1  3023  3024
3024  3023  H     -5.844495   -9.501326   10.031122     2  3022
3025  3024  H     -5.618871   -8.061500   10.440864     2  3022
3026  3025  O     -7.489264   -4.582415    6.738925     1  3026  3027
3027  3026  H     -7.465778   -4.831008    5.814867     2  3025
3028  3027  H     -8.004053   -3.775642    6.757395     2  3025
3029  3028  O     -6.298948  -31.862765    4.803494     1  3029  3030
3030  3029  H     -6.753778  -32.690465    4.959291     2  3028
3031  3030  H     -5.802654  -32.009515    3.998268     2  3028
3032  3031  O    -17.489485   -9.865818   23.958204     1  3032  3033
3033  3032  H    -16.858841   -9.230418   24.297004     2  3031
3034  3033  H    -17.698860   -9.550711   23.078942     2  3031
3035  3034  O    -11.239416   -6.406178   25.123635     1  3035  3036
3036  3035  H    -11.587963   -6.083736   25.954765     2  3034
3037  3036  H    -11.000540   -7.316077   25.300422     2  3034
3038  3037  O    -12.047412   -2.562800   25.046866     1  3038  3039
3039  3038  H    -12.945492   -2.448005   25.357519     2  3037
3040  3039  H    -11.515181   -2.053026   25.657679     2  3037
3041  3040  O    -17.328942  -28.714354    7.372337     1  3041  3042
3042  3041  H    -16.891380  -29.537252    7.590536     2  3040
3043  3042  H    -18.262231  -28.925944    7.393140     2  3040
3044  3043  O    -14.673828    1.931944   21.298034     1  3044  3045
3045  3044  H    -14.613148    2.829315   21.625560     2  3043
3046  3045  H    -14.761854    1.394583   22.085261     2  3043
3047  3046  O    -28.176702   -0.536982   18.445343     1  3047  3048
3048  3047  H    -29.118520   -0.638448   18.307815     2  3046
3049  3048  H    -27.987867   -1.071340   19.216727     2  3046
3050  3049  O    -36.198710   -7.195182    3.609427     1  3050  3051
3051  3050  H    -36.348115   -8.032222    3.169798     2  3049
3052  3051  H    -36.797465   -6.586561    3.176638     2  3049
3053  3052  O      4.205329   -9.870499    4.728150     1  3053  3054
3054  3053  H      3.398791   -9.403982    4.508858     2  3052
3055  3054  H      4.904374   -9.320864    4.373936     2  3052
3056  3055  O      0.562432   -2.966905   10.059343     1  3056  3057
3057  3056  H      1.028308   -2.673613   10.842395     2  3055
3058  3057  H      0.926473   -2.436344    9.350675     2  3055
3059  3058  O     -8.494074  -19.162438   13.104763     1  3059  3060
3060  3059  H     -8.660091  -18.285607   13.450940     2  3058
3061  3060  H     -7.572905  -19.328930   13.304658     2  3058
3062  3061  O     -1.187123   -5.563167   33.546263     1  3062  3063
3063  3062  H     -1.420231   -4.876356   34.170909     2  3061
3064  3063  H     -0.431832   -5.212196   33.074474     2  3061
3065  3064  O    -10.579544  -28.107988   11.675921     1  3065  3066
3066  3065  H    -10.204855  -28.691068   11.015725     2  3064
3067  3066  H    -10.219198  -27.246122   11.467190     2  3064
3068  3067  O    -10.481826  -23.717649   14.869163     1  3068  3069
3069  3068  H    -10.462631  -22.801292   14.593202     2  3067
3070  3069  H    -10.536506  -23.679625   15.824043     2  3067
3071  3070  O    -25.249581  -26.106029    0.982031     1  3071  3072
3072  3071  H    -25.533460  -26.335414    1.866918     2  3070
3073  3072  H    -25.848823  -26.581769    0.406867     2  3070
3074  3073  O    -20.558842  -20.108569   11.499756     1  3074  3075
3075  3074  H    -19.701982  -19.928302   11.886442     2  3073
3076  3075  H    -21.167751  -20.070735   12.237341     2  3073
3077  3076  O    -27.659898    5.247007   15.729618     1  3077  3078
3078  3077  H    -27.854250    6.179854   15.638761     2  3076
3079  3078  H    -27.497157    5.125770   16.665058     2  3076
3080  3079  O     -4.543832  -23.222169   19.422332     1  3080  3081
3081  3080  H     -4.685884  -24.093579   19.792056     2  3079
3082  3081  H     -4.544168  -22.637079   20.179895     2  3079
3083  3082  O    -15.436138  -15.398269    0.344340     1  3083  3084
3084  3083  H    -15.842746  -14.540187    0.465162     2  3082
3085  3084  H    -14.616462  -15.346794    0.835983     2  3082
3086  3085  O     14.447720    4.530237  -33.337229     1  3086  3087
3087  3086  H     14.313528    5.400078  -32.960931     2  3085
3088  3087  H     15.357339    4.316583  -33.129435     2  3085
3089  3088  O    -22.298573    1.100860   25.111245     1  3089  3090
3090  3089  H    -21.818810    0.409194   25.566938     2  3088
3091  3090  H    -22.780348    0.644377   24.421499     2  3088
3092  3091  O     26.617746    8.188317   -9.477375     1  3092  3093
3093  3092  H     26.936570    7.344680   -9.798091     2  3091
3094  3093  H     27.243830    8.438983   -8.798098     2  3091
3095  3094  O     17.946980    8.318236  -18.323278     1  3095  3096
3096  3095  H     16.999252    8.284439  -18.453282     2  3094
3097  3096  H     18.216867    9.138170  -18.736920     2  3094
3098  3097  O     -4.824349  -13.620562   -0.021021     1  3098  3099
3099  3098  H     -5.424867  -12.953044   -0.352726     2  3097
3100  3099  H     -4.448226  -14.016876   -0.806959     2  3097
3101  3100  O     -6.398293   -6.386350   18.575951     1  3101  3102
3102  3101  H     -6.196535   -5.653550   17.994119     2  3100
3103  3102  H     -6.604155   -7.111520   17.986052     2  3100
3104  3103  O     -6.438074   -3.969752   16.740632     1  3104  3105
3105  3104  H     -6.982510   -3.202918   16.562343     2  3103
3106  3105  H     -6.090225   -4.221267   15.885078     2  3103
3107  3106  O      3.614695   -7.873170    7.453955     1  3107  3108
3108  3107  H      3.001226   -8.174488    8.124100     2  3106
3109  3108  H      4.457506   -7.823572    7.905001     2  3106
3110  3109  O     -5.486369  -20.998681    8.465540     1  3110  3111
3111  3110  H     -6.116513  -21.104031    9.178318     2  3109
3112  3111  H     -5.253354  -20.070511    8.486444     2  3109
3113  3112  O     18.109851   20.236840  -12.380274     1  3113  3114
3114  3113  H     18.250006   19.908770  -13.268508     2  3112
3115  3114  H     17.312474   19.797195  -12.085089     2  3112
3116  3115  O    -32.582251    8.130981  -13.088209     1  3116  3117
3117  3116  H    -31.835060    7.944080  -12.519874     2  3115
3118  3117  H    -33.303078    8.312329  -12.485089     2  3115
3119  3118  O    -10.357685  -14.362337    3.269652     1  3119  3120
3120  3119  H    -10.183133  -15.188396    3.720638     2  3118
3121  3120  H     -9.498430  -13.949258    3.184344     2  3118
3122  3121  O     -4.881873  -32.009725    2.465911     1  3122  3123
3123  3122  H     -3.974152  -31.748318    2.620636     2  3121
3124  3123  H     -5.226524  -31.341248    1.873808     2  3121
3125  3124  O     -8.756113  -29.004236    5.930715     1  3125  3126
3126  3125  H     -8.882257  -28.992774    4.981933     2  3124
3127  3126  H     -9.642365  -29.043880    6.290183     2  3124
3128  3127  O     -1.636066  -13.786757   26.271750     1  3128  3129
3129  3128  H     -2.490077  -13.987610   25.888924     2  3127
3130  3129  H     -1.352199  -12.991343   25.821229     2  3127
3131  3130  O     -2.541563   -8.531697   32.200930     1  3131  3132
3132  3131  H     -2.450965   -7.982058   32.979339     2  3130
3133  3132  H     -2.621551   -7.910876   31.476765     2  3130
3134  3133  O     -3.660113  -19.646663   31.126458     1  3134  3135
3135  3134  H     -4.157636  -20.451659   31.270281     2  3133
3136  3135  H     -3.478728  -19.641320   30.186616     2  3133
3137  3136  O     24.571089    3.555911  -20.413023     1  3137  3138
3138  3137  H     24.879741    4.446128  -20.581776     2  3136
3139  3138  H     25.357434    3.073689  -20.157378     2  3136
3140  3139  O    -20.022605  -15.218775   18.551185     1  3140  3141
3141  3140  H    -20.306934  -14.765491   17.757509     2  3139
3142  3141  H    -20.835278  -15.433660   19.009027     2  3139
3143  3142  O     30.540322    7.228465  -14.356094     1  3143  3144
3144  3143  H     30.005197    6.447771  -14.213298     2  3142
3145  3144  H     30.747783    7.541547  -13.475656     2  3142
3146  3145  O    -12.036023  -16.791111   11.093234     1  3146  3147
3147  3146  H    -11.629055  -17.595047   11.416183     2  3145
3148  3147  H    -12.965884  -16.894935   11.295246     2  3145
3149  3148  O     -6.444202  -27.295471   11.821999     1  3149  3150
3150  3149  H     -6.897563  -27.275290   10.979213     2  3148
3151  3150  H     -6.716718  -28.121583   12.221381     2  3148
3152  3151  O     -5.164628  -10.102976   28.652963     1  3152  3153
3153  3152  H     -4.785946   -9.224963   28.609073     2  3151
3154  3153  H     -6.058439   -9.995368   28.327767     2  3151
3155  3154  O     20.973218    1.593464  -24.318465     1  3155  3156
3156  3155  H     21.143616    0.776466  -24.787197     2  3154
3157  3156  H     21.522654    1.540563  -23.536446     2  3154
3158  3157  O     -0.409253    0.167766   34.964776     1  3158  3159
3159  3158  H      0.161718   -0.586446   34.818529     2  3157
3160  3159  H     -1.238216   -0.075271   34.552483     2  3157
3161  3160  O      1.681804   -1.749398   12.217959     1  3161  3162
3162  3161  H      1.537079   -1.533376   13.139165     2  3160
3163  3162  H      2.290148   -2.488161   12.237407     2  3160
3164  3163  O    -12.788532  -15.642216    4.750694     1  3164  3165
3165  3164  H    -11.968375  -15.237887    4.467692     2  3163
3166  3165  H    -12.519172  -16.447488    5.192526     2  3163
3167  3166  O     -0.567154  -27.029142    3.651478     1  3167  3168
3168  3167  H     -1.310432  -27.058869    3.049079     2  3166
3169  3168  H     -0.932515  -27.291069    4.496544     2  3166
3170  3169  O    -14.112396   -3.093427   17.969797     1  3170  3171
3171  3170  H    -14.690489   -3.149398   18.730656     2  3169
3172  3171  H    -13.859744   -3.999631   17.793180     2  3169
3173  3172  O    -20.706022   -1.433411   23.731609     1  3173  3174
3174  3173  H    -21.578122   -1.130400   23.478905     2  3172
3175  3174  H    -20.750585   -2.386245   23.651914     2  3172
3176  3175  O    -15.031104   -1.245290   21.320057     1  3176  3177
3177  3176  H    -15.140727   -2.173673   21.114342     2  3175
3178  3177  H    -15.393917   -0.787045   20.562027     2  3175
3179  3178  O     -0.251050  -30.045939   13.682530     1  3179  3180
3180  3179  H     -0.857593  -30.479268   13.082060     2  3178
3181  3180  H      0.606102  -30.410835   13.462596     2  3178
3182  3181  O    -14.101593  -24.346569    3.582549     1  3182  3183
3183  3182  H    -13.664110  -23.547112    3.289789     2  3181
3184  3183  H    -14.951395  -24.049689    3.908020     2  3181
3185  3184  O    -21.851620   -5.593151    2.346163     1  3185  3186
3186  3185  H    -22.529239   -4.921348    2.270367     2  3184
3187  3186  H    -21.435660   -5.612770    1.484291     2  3184
3188  3187  O    -28.752509   -0.227599    3.433213     1  3188  3189
3189  3188  H    -28.288931    0.104527    2.664434     2  3187
3190  3189  H    -28.759370   -1.177742    3.317403     2  3187
3191  3190  O     -4.003583  -26.288009   11.827000     1  3191  3192
3192  3191  H     -4.082507  -26.181808   10.878989     2  3190
3193  3192  H     -4.789093  -26.772770   12.080404     2  3190
3194  3193  O     -1.838241   -0.904464   14.167418     1  3194  3195
3195  3194  H     -2.213413   -1.448619   14.859786     2  3193
3196  3195  H     -2.595711   -0.578286   13.681539     2  3193
3197  3196  O     -9.105925   -8.453717   -2.109337     1  3197  3198
3198  3197  H     -8.354313   -8.162138   -1.593301     2  3196
3199  3198  H     -9.102622   -9.406805   -2.020773     2  3196
3200  3199  O    -17.822204   -1.248547   27.840886     1  3200  3201
3201  3200  H    -18.656158   -0.823877   27.639868     2  3199
3202  3201  H    -18.034018   -1.880016   28.528355     2  3199
3203  3202  O     -6.710343  -26.181576   14.386618     1  3203  3204
3204  3203  H     -7.473463  -25.810897   13.943360     2  3202
3205  3204  H     -6.294098  -26.734792   13.725616     2  3202
3206  3205  O    -15.982565  -12.622481    6.783676     1  3206  3207
3207  3206  H    -16.252348  -12.030319    6.081684     2  3205
3208  3207  H    -16.025808  -12.089194    7.577381     2  3205
3209  3208  O     -2.265340  -11.596082   -1.251703     1  3209  3210
3210  3209  H     -2.084712  -10.904089   -1.887903     2  3208
3211  3210  H     -2.105162  -12.409594   -1.730006     2  3208
3212  3211  O     -2.327525   -5.376380    1.561631     1  3212  3213
3213  3212  H     -1.671322   -5.421851    2.257017     2  3211
3214  3213  H     -3.008805   -5.991127    1.833982     2  3211
3215  3214  O    -15.810722  -19.045489    1.953649     1  3215  3216
3216  3215  H    -15.114723  -18.697789    2.511253     2  3214
3217  3216  H    -15.555708  -19.953371    1.789491     2  3214
3218  3217  O    -29.571217   -9.461237    5.351896     1  3218  3219
3219  3218  H    -29.890545  -10.017968    4.641747     2  3217
3220  3219  H    -29.703339   -9.982732    6.143615     2  3217
3221  3220  O    -15.899382   -6.390927   19.565100     1  3221  3222
3222  3221  H    -15.635423   -7.009060   18.883580     2  3220
3223  3222  H    -15.593457   -6.787832   20.380641     2  3220
3224  3223  O     -7.676243  -23.451813    7.308754     1  3224  3225
3225  3224  H     -8.373567  -24.052003    7.044667     2  3223
3226  3225  H     -6.870542  -23.874060    7.010786     2  3223
3227  3226  O    -10.333629   -9.348436   28.027427     1  3227  3228
3228  3227  H    -11.097638   -9.668992   27.548088     2  3226
3229  3228  H    -10.691852   -8.996701   28.842405     2  3226
3230  3229  O     -4.806316  -25.561079   20.674486     1  3230  3231
3231  3230  H     -5.744182  -25.736612   20.598159     2  3229
3232  3231  H     -4.387603  -26.291630   20.219286     2  3229
3233  3232  O     -2.441759  -19.759904   23.721356     1  3233  3234
3234  3233  H     -2.040953  -19.319609   24.470840     2  3232
3235  3234  H     -1.936431  -20.566294   23.618346     2  3232
3236  3235  O     17.872739    6.254455  -26.714581     1  3236  3237
3237  3236  H     17.641571    6.768206  -25.940725     2  3235
3238  3237  H     18.409189    5.537899  -26.375467     2  3235
3239  3238  O    -27.618248  -13.552887    3.173667     1  3239  3240
3240  3239  H    -28.131933  -13.999001    2.500360     2  3238
3241  3240  H    -28.108659  -12.751852    3.358249     2  3238
3242  3241  O    -15.589754   -3.929662   20.257043     1  3242  3243
3243  3242  H    -15.530946   -4.802421   19.868370     2  3241
3244  3243  H    -15.160502   -4.016572   21.108172     2  3241
3245  3244  O    -15.692573    2.168843   31.807293     1  3245  3246
3246  3245  H    -15.038206    2.867320   31.820175     2  3244
3247  3246  H    -15.804611    1.927964   32.726889     2  3244
3248  3247  O     -1.482678   -9.879990   19.997527     1  3248  3249
3249  3248  H     -1.274573   -9.524056   19.133678     2  3247
3250  3249  H     -0.650831   -9.863127   20.470791     2  3247
3251  3250  O     -5.824113  -25.188636    6.872477     1  3251  3252
3252  3251  H     -5.010839  -25.028298    6.393824     2  3250
3253  3252  H     -6.249202  -25.899130    6.392135     2  3250
3254  3253  O    -10.881095   -5.946976   17.774437     1  3254  3255
3255  3254  H    -10.695905   -6.831049   18.091218     2  3253
3256  3255  H    -10.449998   -5.370698   18.405539     2  3253
3257  3256  O     -1.752105  -23.141664   19.162197     1  3257  3258
3258  3257  H     -1.744699  -23.703846   19.936876     2  3256
3259  3258  H     -2.673443  -23.097669   18.906401     2  3256
3260  3259  O    -10.817090  -21.969161    4.475327     1  3260  3261
3261  3260  H     -9.983218  -22.029784    4.009267     2  3259
3262  3261  H    -10.572555  -21.778821    5.380979     2  3259
3263  3262  O     -1.313509  -29.111204    5.921164     1  3263  3264
3264  3263  H     -0.657738  -28.463857    6.180274     2  3262
3265  3264  H     -1.992503  -28.601363    5.479282     2  3262
3266  3265  O     -0.352449  -27.559276   -4.817719     1  3266  3267
3267  3266  H      0.421237  -27.361309   -4.290034     2  3265
3268  3267  H     -0.981349  -27.923020   -4.194497     2  3265
3269  3268  O    -24.156444   -6.619495   19.201554     1  3269  3270
3270  3269  H    -23.486566   -6.065836   19.602749     2  3268
3271  3270  H    -23.999399   -6.542479   18.260471     2  3268
3272  3271  O     -9.431539  -15.486467   11.638871     1  3272  3273
3273  3272  H     -9.369895  -15.303914   12.576477     2  3271
3274  3273  H    -10.296381  -15.881308   11.527605     2  3271
3275  3274  O    -20.484145   -0.115057   27.141923     1  3275  3276
3276  3275  H    -20.961966    0.392487   27.797910     2  3274
3277  3276  H    -20.829026   -1.003794   27.228155     2  3274
3278  3277  O    -19.340881  -26.841858    4.202355     1  3278  3279
3279  3278  H    -19.025633  -26.250561    4.885890     2  3277
3280  3279  H    -20.203854  -26.500015    3.968576     2  3277
3281  3280  O    -17.460009    4.692671   21.103412     1  3281  3282
3282  3281  H    -17.229778    4.740935   22.031257     2  3280
3283  3282  H    -18.380587    4.952865   21.070725     2  3280
3284  3283  O      0.705343  -12.715047   13.937571     1  3284  3285
3285  3284  H     -0.030226  -12.681923   13.325957     2  3283
3286  3285  H      1.482709  -12.682400   13.380015     2  3283
3287  3286  O      1.392902  -25.550766    2.475758     1  3287  3288
3288  3287  H      0.862104  -25.382361    1.697218     2  3286
3289  3288  H      0.792806  -25.976822    3.087796     2  3286
3290  3289  O     22.248868   16.751707   -9.563025     1  3290  3291
3291  3290  H     23.154566   16.587223   -9.825491     2  3289
3292  3291  H     22.147256   17.700901   -9.633287     2  3289
3293  3292  O    -10.218446  -21.056378   14.325155     1  3293  3294
3294  3293  H    -10.877890  -20.523128   14.769013     2  3292
3295  3294  H     -9.577102  -20.424121   14.000870     2  3292
3296  3295  O      0.235676  -25.022212   18.364114     1  3296  3297
3297  3296  H      0.072542  -25.457765   17.527506     2  3295
3298  3297  H     -0.384680  -24.293426   18.380242     2  3295
3299  3298  O    -12.521669   -9.746684   19.600590     1  3299  3300
3300  3299  H    -11.745045   -9.273423   19.302077     2  3298
3301  3300  H    -12.200558  -10.320005   20.296595     2  3298
3302  3301  O     -7.665228   -6.386137   23.514475     1  3302  3303
3303  3302  H     -7.727877   -5.433468   23.445712     2  3301
3304  3303  H     -7.007773   -6.631031   22.863314     2  3301
3305  3304  O     -5.606561  -16.344489   20.926802     1  3305  3306
3306  3305  H     -4.674155  -16.558903   20.956403     2  3304
3307  3306  H     -6.049863  -17.184173   21.047825     2  3304
3308  3307  O    -13.586277   -6.571274    6.384106     1  3308  3309
3309  3308  H    -14.126474   -7.316019    6.648253     2  3307
3310  3309  H    -14.211520   -5.927184    6.051765     2  3307
3311  3310  O     -4.745396  -16.365516    5.725173     1  3311  3312
3312  3311  H     -5.260075  -16.910191    5.129634     2  3310
3313  3312  H     -4.002665  -16.069922    5.198667     2  3310
3314  3313  O     -5.111274  -29.448196    5.346093     1  3314  3315
3315  3314  H     -5.542426  -30.254287    5.062268     2  3313
3316  3315  H     -4.830242  -29.629337    6.242999     2  3313
3317  3316  O    -17.255503  -10.033101   -0.524945     1  3317  3318
3318  3317  H    -17.106668   -9.150914   -0.865278     2  3316
3319  3318  H    -18.192610  -10.183388   -0.649350     2  3316
3320  3319  O     24.311500    2.122930  -24.180068     1  3320  3321
3321  3320  H     24.860022    2.742411  -24.661314     2  3319
3322  3321  H     23.525240    2.621341  -23.957330     2  3319
3323  3322  O    -14.642368   -0.781706   -2.058691     1  3323  3324
3324  3323  H    -15.460823   -0.871978   -2.546763     2  3322
3325  3324  H    -13.961098   -0.778435   -2.731068     2  3322
3326  3325  O    -10.335653   -8.446818   18.569686     1  3326  3327
3327  3326  H     -9.753734   -8.986304   18.034376     2  3325
3328  3327  H     -9.913050   -8.416864   19.428023     2  3325
3329  3328  O    -11.661687  -25.573175    4.304596     1  3329  3330
3330  3329  H    -12.456091  -25.043603    4.235986     2  3328
3331  3330  H    -11.961358  -26.473131    4.176118     2  3328
3332  3331  O      4.206463  -25.808958   21.693226     1  3332  3333
3333  3332  H      4.033037  -26.617139   22.175925     2  3331
3334  3333  H      3.413588  -25.662735   21.177281     2  3331
3335  3334  O    -11.230812  -19.067480    3.369022     1  3335  3336
3336  3335  H    -11.238047  -19.516581    4.214296     2  3334
3337  3336  H    -11.122807  -19.768167    2.725901     2  3334
3338  3337  O    -18.399352   -9.093108   21.381195     1  3338  3339
3339  3338  H    -18.821637   -8.410819   20.859287     2  3337
3340  3339  H    -19.091183   -9.734686   21.542381     2  3337
3341  3340  O    -22.493830   -8.322798    3.031264     1  3341  3342
3342  3341  H    -21.934183   -7.599896    2.747645     2  3340
3343  3342  H    -22.620032   -8.851883    2.243626     2  3340
3344  3343  O    -10.624529   -0.553099   26.389945     1  3344  3345
3345  3344  H    -10.517817    0.122318   25.720127     2  3343
3346  3345  H    -11.156190   -0.136556   27.068222     2  3343
3347  3346  O     -6.943901   -9.946567   23.154194     1  3347  3348
3348  3347  H     -6.072406   -9.575205   23.017017     2  3346
3349  3348  H     -6.782282  -10.783701   23.589300     2  3346
3350  3349  O     -2.895317   -3.034707   25.765522     1  3350  3351
3351  3350  H     -3.628048   -3.401175   25.270510     2  3349
3352  3351  H     -2.282694   -3.763762   25.862496     2  3349
3353  3352  O     -3.990015  -31.745113   13.050300     1  3353  3354
3354  3353  H     -3.961735  -32.679876   13.254383     2  3352
3355  3354  H     -4.492388  -31.358035   13.767255     2  3352
3356  3355  O     24.902515    6.131196  -23.227682     1  3356  3357
3357  3356  H     25.219565    6.924266  -23.659830     2  3355
3358  3357  H     25.479060    6.023232  -22.471261     2  3355
3359  3358  O    -13.557561    1.256682   24.641614     1  3359  3360
3360  3359  H    -14.285827    0.646605   24.758522     2  3358
3361  3360  H    -13.022906    0.862874   23.952200     2  3358
3362  3361  O    -13.146870  -32.146599    0.522829     1  3362  3363
3363  3362  H    -13.609366  -32.851933    0.070244     2  3361
3364  3363  H    -13.314666  -31.369149   -0.009757     2  3361
3365  3364  O     -2.931237  -17.488710   10.864130     1  3365  3366
3366  3365  H     -2.163562  -17.106061   10.439291     2  3364
3367  3366  H     -2.757354  -17.397724   11.800996     2  3364
3368  3367  O    -15.073079  -31.084171    2.704681     1  3368  3369
3369  3368  H    -14.489192  -31.350602    3.414837     2  3367
3370  3369  H    -14.710986  -31.505757    1.925331     2  3367
3371  3370  O     -1.839872   -8.707258   24.359880     1  3371  3372
3372  3371  H     -2.371267   -9.005908   23.621870     2  3370
3373  3372  H     -1.482762   -7.866512   24.073787     2  3370
3374  3373  O     -3.819518   -1.495029   16.064665     1  3374  3375
3375  3374  H     -4.697394   -1.538724   15.685644     2  3373
3376  3375  H     -3.963703   -1.236232   16.974866     2  3373
3377  3376  O    -12.917226  -14.611238   21.679774     1  3377  3378
3378  3377  H    -13.107984  -15.518668   21.442257     2  3376
3379  3378  H    -13.763282  -14.166596   21.627678     2  3376
3380  3379  O    -14.588761   -2.763485   26.090110     1  3380  3381
3381  3380  H    -15.500160   -3.045240   26.011387     2  3379
3382  3381  H    -14.616913   -2.028152   26.702257     2  3379
3383  3382  O      2.893566  -22.809445    7.632320     1  3383  3384
3384  3383  H      2.528411  -23.114123    8.463021     2  3382
3385  3384  H      3.806532  -22.603170    7.832759     2  3382
3386  3385  O      2.171667  -14.636710   18.990635     1  3386  3387
3387  3386  H      1.729694  -15.308929   18.471970     2  3385
3388  3387  H      2.635438  -15.124843   19.670984     2  3385
3389  3388  O     -8.723541  -10.402224   33.023286     1  3389  3390
3390  3389  H     -8.620273  -10.272584   32.080545     2  3388
3391  3390  H     -8.040978  -11.031979   33.255122     2  3388
3392  3391  O    -10.082351   -3.010839   18.534344     1  3392  3393
3393  3392  H     -9.428780   -2.370859   18.816305     2  3391
3394  3393  H    -10.716332   -3.038068   19.250974     2  3391
3395  3394  O     -5.147493  -30.361485   15.029822     1  3395  3396
3396  3395  H     -5.521558  -29.598333   15.470171     2  3394
3397  3396  H     -4.750531  -30.874202   15.733935     2  3394
3398  3397  O     25.682147   14.934500  -13.623732     1  3398  3399
3399  3398  H     26.474616   14.533422  -13.980608     2  3397
3400  3399  H     25.292522   14.251608  -13.077763     2  3397
3401  3400  O     -6.342571   -2.411558   -0.652911     1  3401  3402
3402  3401  H     -6.903845   -1.637087   -0.690311     2  3400
3403  3402  H     -6.068557   -2.553343   -1.559026     2  3400
3404  3403  O    -15.333709  -13.234161   22.580587     1  3404  3405
3405  3404  H    -16.174692  -12.865310   22.310532     2  3403
3406  3405  H    -15.540077  -13.763404   23.351006     2  3403
3407  3406  O     -9.003272   -8.227450   21.023712     1  3407  3408
3408  3407  H     -9.015618   -7.857278   21.906350     2  3406
3409  3408  H     -9.299630   -9.130413   21.138001     2  3406
3410  3409  O    -11.953292  -19.202586   15.434749     1  3410  3411
3411  3410  H    -12.621544  -19.670791   14.934295     2  3409
3412  3411  H    -11.913253  -18.336210   15.029752     2  3409
3413  3412  O    -12.161121  -26.143338    7.594965     1  3413  3414
3414  3413  H    -13.079901  -26.396589    7.684059     2  3412
3415  3414  H    -12.027394  -25.482420    8.274330     2  3412
3416  3415  O    -16.031205   -4.887628   16.002453     1  3416  3417
3417  3416  H    -15.237250   -5.195630   16.439489     2  3415
3418  3417  H    -15.725266   -4.544443   15.162896     2  3415
3419  3418  O     -2.724902   -8.524169    4.788840     1  3419  3420
3420  3419  H     -2.976251   -7.688504    5.182184     2  3418
3421  3420  H     -3.386746   -9.143201    5.097052     2  3418
3422  3421  O      1.682602   -5.637126   16.036881     1  3422  3423
3423  3422  H      2.273974   -6.072585   15.422971     2  3421
3424  3423  H      2.247346   -5.048194   16.537335     2  3421
3425  3424  O    -15.469218    4.018118   19.086020     1  3425  3426
3426  3425  H    -14.720623    3.830893   19.652398     2  3424
3427  3426  H    -16.224795    4.000943   19.673421     2  3424
3428  3427  O      3.848684  -28.885625   14.232619     1  3428  3429
3429  3428  H      3.402493  -29.292772   14.975166     2  3427
3430  3429  H      3.149395  -28.695713   13.607190     2  3427
3431  3430  O     -7.526012  -30.689549    7.510971     1  3431  3432
3432  3431  H     -7.209505  -31.265336    6.814893     2  3430
3433  3432  H     -7.917810  -29.948082    7.049502     2  3430
3434  3433  O     -2.856454  -18.976382   14.531999     1  3434  3435
3435  3434  H     -2.524891  -18.815416   15.415394     2  3433
3436  3435  H     -2.365280  -19.739075   14.226582     2  3433
3437  3436  O    -14.624541  -35.288614    3.774760     1  3437  3438
3438  3437  H    -14.222731  -35.715514    4.531422     2  3436
3439  3438  H    -15.293143  -34.715329    4.149658     2  3436
3440  3439  O    -11.015288  -31.331736    2.416262     1  3440  3441
3441  3440  H    -11.388258  -31.535425    3.273954     2  3439
3442  3441  H    -11.648602  -31.682070    1.789835     2  3439
3443  3442  O    -12.926607  -11.442002    1.101340     1  3443  3444
3444  3443  H    -12.115870  -11.023233    0.812256     2  3442
3445  3444  H    -12.655513  -12.310905    1.397561     2  3442
3446  3445  O    -12.464799  -35.200838    1.857444     1  3446  3447
3447  3446  H    -12.667276  -34.820844    1.002553     2  3445
3448  3447  H    -13.120003  -34.827775    2.447158     2  3445
3449  3448  O     -6.203058    1.799394    4.780848     1  3449  3450
3450  3449  H     -5.863419    0.933950    4.553069     2  3448
3451  3450  H     -7.146510    1.733413    4.633274     2  3448
3452  3451  O    -12.233564  -17.913071    6.216951     1  3452  3453
3453  3452  H    -12.642122  -18.775052    6.296331     2  3451
3454  3453  H    -11.832042  -17.758149    7.071942     2  3451
3455  3454  O     -8.025225  -28.890482    0.810033     1  3455  3456
3456  3455  H     -8.927879  -28.958065    0.498776     2  3454
3457  3456  H     -7.698284  -28.078105    0.423530     2  3454
3458  3457  O    -25.314572   -7.423451    3.724327     1  3458  3459
3459  3458  H    -25.706536   -8.188396    4.145579     2  3457
3460  3459  H    -24.470368   -7.735283    3.398270     2  3457
3461  3460  O     15.060203    7.094277  -15.859622     1  3461  3462
3462  3461  H     15.677984    7.767918  -15.575397     2  3460
3463  3462  H     15.456415    6.722390  -16.647625     2  3460
3464  3463  O     -3.456495   -5.166540    5.026033     1  3464  3465
3465  3464  H     -2.579547   -4.833182    4.836122     2  3463
3466  3465  H     -3.689125   -4.766359    5.863870     2  3463
3467  3466  O     -7.685238  -25.516467   20.201680     1  3467  3468
3468  3467  H     -8.410451  -26.088552   20.452711     2  3466
3469  3468  H     -7.471557  -25.778717   19.306249     2  3466
3470  3469  O     -0.829914  -34.548937   15.108911     1  3470  3471
3471  3470  H     -1.501525  -34.463298   14.432275     2  3469
3472  3471  H     -0.283608  -35.277483   14.813951     2  3469
3473  3472  O     -3.634344  -24.919649   15.567330     1  3473  3474
3474  3473  H     -4.128598  -25.738397   15.527378     2  3472
3475  3474  H     -4.182089  -24.333924   16.089952     2  3472
3476  3475  O     21.454904   -1.564630  -20.963718     1  3476  3477
3477  3476  H     22.154786   -1.813209  -21.567544     2  3475
3478  3477  H     20.753790   -1.240813  -21.529238     2  3475
3479  3478  O     -1.960063   -3.599236   28.672807     1  3479  3480
3480  3479  H     -1.406034   -3.072496   29.248852     2  3478
3481  3480  H     -2.202517   -3.004318   27.963216     2  3478
3482  3481  O    -12.443898  -22.893424    7.505149     1  3482  3483
3483  3482  H    -12.483227  -23.419854    6.706678     2  3481
3484  3483  H    -11.562503  -22.520099    7.503298     2  3481
3485  3484  O    -22.850399   -4.351788   16.448148     1  3485  3486
3486  3485  H    -22.594316   -4.209102   17.359353     2  3484
3487  3486  H    -22.132922   -4.863524   16.074540     2  3484
3488  3487  O     -1.187351  -20.979186   13.592967     1  3488  3489
3489  3488  H     -0.585201  -21.321643   12.932384     2  3487
3490  3489  H     -1.943988  -21.564195   13.554286     2  3487
3491  3490  O    -14.313838  -17.076322    8.136912     1  3491  3492
3492  3491  H    -13.953965  -16.236219    7.852397     2  3490
3493  3492  H    -14.815217  -17.389893    7.384234     2  3490
3494  3493  O    -11.733511  -14.433472   16.513887     1  3494  3495
3495  3494  H    -10.930121  -14.427808   17.034238     2  3493
3496  3495  H    -12.094044  -13.553076   16.619483     2  3493
3497  3496  O    -10.885240   -7.966032   30.228957     1  3497  3498
3498  3497  H    -11.217433   -8.553492   30.907758     2  3496
3499  3498  H    -11.340782   -7.138536   30.383756     2  3496
3500  3499  O     18.370858    2.277782  -33.652181     1  3500  3501
3501  3500  H     17.895495    1.548185  -33.254753     2  3499
3502  3501  H     18.490584    2.903691  -32.937943     2  3499
3503  3502  O     -8.874416   -5.622495   19.625796     1  3503  3504
3504  3503  H     -8.922612   -6.103655   20.451867     2  3502
3505  3504  H     -8.073774   -5.940968   19.208926     2  3502
3506  3505  O     -9.617589  -19.189789   23.749107     1  3506  3507
3507  3506  H    -10.303330  -18.524253   23.804355     2  3505
3508  3507  H     -9.959572  -19.836029   23.131325     2  3505
3509  3508  O     -5.152783  -15.460342   13.787703     1  3509  3510
3510  3509  H     -5.298010  -15.111245   12.908344     2  3508
3511  3510  H     -4.231579  -15.275205   13.970294     2  3508
3512  3511  O    -16.950257   -2.564848   22.980451     1  3512  3513
3513  3512  H    -16.132834   -3.046714   22.854525     2  3511
3514  3513  H    -17.117774   -2.618186   23.921367     2  3511
3515  3514  O    -11.635127  -22.935707   19.504334     1  3515  3516
3516  3515  H    -11.566995  -23.860736   19.740787     2  3514
3517  3516  H    -12.575540  -22.778002   19.420757     2  3514
3518  3517  O     -6.775016    1.128971    7.668879     1  3518  3519
3519  3518  H     -5.832361    0.984343    7.586918     2  3517
3520  3519  H     -7.061330    1.352971    6.783397     2  3517
3521  3520  O     -9.579923  -15.070010    9.008581     1  3521  3522
3522  3521  H     -9.330470  -14.906853    9.918188     2  3520
3523  3522  H    -10.327897  -14.492131    8.857508     2  3520
3524  3523  O    -23.436844  -16.126970   13.904976     1  3524  3525
3525  3524  H    -24.239636  -16.143716   14.426011     2  3523
3526  3525  H    -22.913254  -15.426076   14.293347     2  3523
3527  3526  O    -17.260839    4.615776   23.986919     1  3527  3528
3528  3527  H    -16.424358    4.390067   23.579996     2  3526
3529  3528  H    -17.820926    3.857558   23.820670     2  3526
3530  3529  O      3.211355  -21.597706   -7.849740     1  3530  3531
3531  3530  H      2.841884  -21.275140   -8.671734     2  3529
3532  3531  H      2.579822  -22.247590   -7.541443     2  3529
3533  3532  O     -9.845043  -25.017313    6.121815     1  3533  3534
3534  3533  H    -10.272087  -25.485510    6.839211     2  3532
3535  3534  H    -10.379778  -25.216499    5.353300     2  3532
3536  3535  O     -2.247212  -12.156376   16.919577     1  3536  3537
3537  3536  H     -1.429596  -12.585446   16.667316     2  3535
3538  3537  H     -2.470261  -11.605068   16.169551     2  3535
3539  3538  O    -12.556094    0.310260   28.451998     1  3539  3540
3540  3539  H    -13.440965   -0.051721   28.405041     2  3538
3541  3540  H    -12.668967    1.243912   28.273713     2  3538
3542  3541  O     -2.464346  -11.982017    3.681598     1  3542  3543
3543  3542  H     -3.276392  -12.083503    4.178100     2  3541
3544  3543  H     -1.899754  -12.687161    3.998205     2  3541
3545  3544  O     34.483641   11.711011   -6.394206     1  3545  3546
3546  3545  H     35.015132   11.088194   -5.898376     2  3544
3547  3546  H     34.333251   11.281217   -7.236163     2  3544
3548  3547  O      4.906161   -9.839574   12.263466     1  3548  3549
3549  3548  H      5.218334   -9.996496   11.372312     2  3547
3550  3549  H      5.499506   -9.174177   12.611920     2  3547
3551  3550  O     24.459325   11.602077   -6.760433     1  3551  3552
3552  3551  H     23.853267   11.063696   -7.269423     2  3550
3553  3552  H     25.010183   12.028984   -7.416587     2  3550
3554  3553  O     27.159274   17.700675   -6.525233     1  3554  3555
3555  3554  H     26.588937   16.987550   -6.238178     2  3553
3556  3555  H     27.371075   17.487577   -7.434057     2  3553
3557  3556  O      0.345456  -23.851892    6.065593     1  3557  3558
3558  3557  H      1.151562  -23.420735    6.349367     2  3556
3559  3558  H      0.033542  -23.319760    5.333626     2  3556
3560  3559  O      0.298945  -27.400251   21.071172     1  3560  3561
3561  3560  H      0.212817  -27.248389   22.012316     2  3559
3562  3561  H      0.029963  -28.310773   20.949395     2  3559
3563  3562  O     -2.036549  -29.456776   10.650938     1  3563  3564
3564  3563  H     -1.429420  -29.487915    9.911575     2  3562
3565  3564  H     -2.904681  -29.440239   10.248067     2  3562
3566  3565  O     -4.528229   -9.885905   -6.617599     1  3566  3567
3567  3566  H     -3.636563   -9.577806   -6.779578     2  3565
3568  3567  H     -4.436838  -10.523955   -5.909948     2  3565
3569  3568  O     -1.725151  -25.474879   26.961009     1  3569  3570
3570  3569  H     -2.522500  -25.951294   26.729721     2  3568
3571  3570  H     -1.685578  -24.753882   26.332655     2  3568
3572  3571  O     23.993535    0.026985  -28.747622     1  3572  3573
3573  3572  H     23.735700    0.527223  -27.973340     2  3571
3574  3573  H     23.168119   -0.289583  -29.114644     2  3571
3575  3574  O     -1.536734  -31.852143    3.425977     1  3575  3576
3576  3575  H     -1.233904  -31.113760    2.897472     2  3574
3577  3576  H     -1.229106  -31.656009    4.310921     2  3574
3578  3577  O     -9.790209   -5.698944   12.419368     1  3578  3579
3579  3578  H     -9.543171   -6.617352   12.311063     2  3577
3580  3579  H    -10.480602   -5.712696   13.082240     2  3577
3581  3580  O    -18.415767  -22.327531    2.151230     1  3581  3582
3582  3581  H    -17.514507  -22.607433    2.311281     2  3580
3583  3582  H    -18.900934  -23.142577    2.022597     2  3580
3584  3583  O     -8.987070  -25.585883   13.114877     1  3584  3585
3585  3584  H     -8.943639  -25.240760   12.223117     2  3583
3586  3585  H     -9.663602  -25.060977   13.542672     2  3583
3587  3586  O    -16.353242   -7.176983   10.733455     1  3587  3588
3588  3587  H    -16.899028   -6.397037   10.633284     2  3586
3589  3588  H    -15.606870   -7.023627   10.154109     2  3586
3590  3589  O     -9.695106  -17.441461   20.463037     1  3590  3591
3591  3590  H    -10.642986  -17.308429   20.455432     2  3589
3592  3591  H     -9.458982  -17.538537   19.540512     2  3589
3593  3592  O     -4.155151  -25.409762   -2.783568     1  3593  3594
3594  3593  H     -3.577182  -25.027463   -2.123242     2  3592
3595  3594  H     -4.614405  -24.660626   -3.163192     2  3592
3596  3595  O    -20.091881    1.393493   20.186494     1  3596  3597
3597  3596  H    -19.376188    0.889393   20.573660     2  3595
3598  3597  H    -19.658671    2.014426   19.600830     2  3595
3599  3598  O    -21.114367   -7.957713    7.340199     1  3599  3600
3600  3599  H    -20.967940   -7.696303    6.431103     2  3598
3601  3600  H    -20.389811   -8.550761    7.539058     2  3598
3602  3601  O     -9.325401  -24.757290   10.484506     1  3602  3603
3603  3602  H    -10.245680  -24.614735   10.263156     2  3601
3604  3603  H     -8.878766  -23.970405   10.172157     2  3601
3605  3604  O     -8.866138  -17.015593   14.532493     1  3605  3606
3606  3605  H     -8.459388  -16.157841   14.655157     2  3604
3607  3606  H     -9.249072  -17.223689   15.384720     2  3604
3608  3607  O    -11.794705  -15.224229   -1.061014     1  3608  3609
3609  3608  H    -12.235714  -14.589570   -1.625771     2  3607
3610  3609  H    -11.373757  -15.833426   -1.667572     2  3607
3611  3610  O    -14.969791  -17.922563   10.761580     1  3611  3612
3612  3611  H    -15.712805  -17.420955   11.097066     2  3610
3613  3612  H    -14.720331  -17.471543    9.954993     2  3610
3614  3613  O     -1.614081  -31.929695    6.455612     1  3614  3615
3615  3614  H     -0.886235  -32.288703    6.963139     2  3613
3616  3615  H     -1.518796  -30.980782    6.537575     2  3613
3617  3616  O    -15.434468  -15.183241   19.147087     1  3617  3618
3618  3617  H    -16.350667  -14.942595   19.284561     2  3616
3619  3618  H    -14.942849  -14.392105   19.367647     2  3616
3620  3619  O    -20.882323  -13.738721    5.702511     1  3620  3621
3621  3620  H    -20.238206  -13.081117    5.965004     2  3619
3622  3621  H    -20.666336  -13.935779    4.791056     2  3619
3623  3622  O     -1.385266  -31.832984   12.004830     1  3623  3624
3624  3623  H     -2.229895  -32.128763   12.344460     2  3622
3625  3624  H     -1.602475  -31.355302   11.204285     2  3622
3626  3625  O    -16.116121  -25.347716   10.748852     1  3626  3627
3627  3626  H    -16.119590  -24.589229   10.164971     2  3625
3628  3627  H    -17.032034  -25.458372   11.003977     2  3625
3629  3628  O     -9.567146   -3.884838   -1.834750     1  3629  3630
3630  3629  H     -9.345178   -4.399328   -1.058694     2  3628
3631  3630  H     -9.043642   -4.271357   -2.536732     2  3628
3632  3631  O     -6.599586  -21.604499   15.255223     1  3632  3633
3633  3632  H     -6.630757  -22.178861   14.490130     2  3631
3634  3633  H     -6.354909  -20.748725   14.903062     2  3631
3635  3634  O     -0.702510  -26.731262   16.138739     1  3635  3636
3636  3635  H     -0.833592  -27.643246   16.398226     2  3634
3637  3636  H     -1.491612  -26.506183   15.645901     2  3634
3638  3637  O     17.692683   24.831780  -10.621962     1  3638  3639
3639  3638  H     18.248952   25.321796  -11.227504     2  3637
3640  3639  H     16.799835   25.016112  -10.913637     2  3637
3641  3640  O     -7.396488  -25.550076   17.421289     1  3641  3642
3642  3641  H     -7.074675  -26.071168   16.685673     2  3640
3643  3642  H     -6.907125  -24.729271   17.366212     2  3640
3644  3643  O     -3.070371  -26.340327    1.551716     1  3644  3645
3645  3644  H     -3.152056  -25.472549    1.156089     2  3643
3646  3645  H     -3.556206  -26.275920    2.373937     2  3643
3647  3646  O    -17.391207   -9.257456   13.191555     1  3647  3648
3648  3647  H    -17.408318   -8.954746   12.283643     2  3646
3649  3648  H    -18.310498   -9.269104   13.458013     2  3646
3650  3649  O     -6.445308  -21.903430   24.486948     1  3650  3651
3651  3650  H     -5.571445  -22.187400   24.755197     2  3649
3652  3651  H     -6.298903  -21.074588   24.031077     2  3649
3653  3652  O     27.294938    8.876944  -12.907846     1  3653  3654
3654  3653  H     26.515821    9.368228  -12.647371     2  3652
3655  3654  H     27.886789    8.951044  -12.159212     2  3652
3656  3655  O     -1.985505  -14.499113    6.775334     1  3656  3657
3657  3656  H     -1.127602  -14.449016    6.353761     2  3655
3658  3657  H     -2.340355  -13.613032    6.703409     2  3655
3659  3658  O     -7.087011   -3.604191    1.629249     1  3659  3660
3660  3659  H     -6.341867   -3.650015    2.228325     2  3658
3661  3660  H     -6.753109   -3.131823    0.866615     2  3658
3662  3661  O      4.949918  -27.280594    8.711393     1  3662  3663
3663  3662  H      4.037612  -27.151593    8.970791     2  3661
3664  3663  H      4.931263  -27.269000    7.754445     2  3661
3665  3664  O    -13.114188   -4.980386   32.544227     1  3665  3666
3666  3665  H    -13.670521   -5.679618   32.201009     2  3664
3667  3666  H    -12.395864   -4.914535   31.915017     2  3664
3668  3667  O     -1.497770  -34.955785    9.504352     1  3668  3669
3669  3668  H     -1.002306  -35.548667   10.069363     2  3667
3670  3669  H     -0.903420  -34.222314    9.346243     2  3667
3671  3670  O    -13.702149  -17.969369    3.304811     1  3671  3672
3672  3671  H    -12.908610  -18.503493    3.340026     2  3670
3673  3672  H    -13.409491  -17.088965    3.540332     2  3670
3674  3673  O     -1.870775   -5.048030   21.610292     1  3674  3675
3675  3674  H     -1.632177   -4.184019   21.274452     2  3673
3676  3675  H     -2.154606   -5.535994   20.837271     2  3673
3677  3676  O     -8.247433  -17.000853    1.432358     1  3677  3678
3678  3677  H     -9.130275  -17.329545    1.602012     2  3676
3679  3678  H     -8.204821  -16.907644    0.480661     2  3676
3680  3679  O     34.411150   13.769655   -4.028438     1  3680  3681
3681  3680  H     34.647533   13.132567   -4.702585     2  3679
3682  3681  H     34.718830   13.378945   -3.210569     2  3679
3683  3682  O     -1.416384  -24.997805   13.898530     1  3683  3684
3684  3683  H     -2.250990  -25.001757   14.367198     2  3682
3685  3684  H     -1.403469  -25.829213   13.424373     2  3682
3686  3685  O    -16.477178  -17.940519   19.505702     1  3686  3687
3687  3686  H    -16.205118  -17.040331   19.327162     2  3685
3688  3687  H    -15.792499  -18.289442   20.076403     2  3685
3689  3688  O    -11.370176  -10.284737    5.650303     1  3689  3690
3690  3689  H    -12.085930  -10.767531    5.236979     2  3688
3691  3690  H    -11.574827  -10.305847    6.585132     2  3688
3692  3691  O     -9.693883  -17.866284   17.244562     1  3692  3693
3693  3692  H    -10.460830  -18.348364   16.935334     2  3691
3694  3693  H     -8.986715  -18.511355   17.239169     2  3691
3695  3694  O    -19.439462  -18.073400    7.482185     1  3695  3696
3696  3695  H    -20.079680  -17.385723    7.665088     2  3694
3697  3696  H    -19.213482  -17.951793    6.560027     2  3694
3698  3697  O     -8.635409  -23.392366   21.637944     1  3698  3699
3699  3698  H     -8.326231  -24.212036   21.252223     2  3697
3700  3699  H     -8.428969  -22.725875   20.982655     2  3697
3701  3700  O    -16.595549  -22.597265    9.339837     1  3701  3702
3702  3701  H    -15.985811  -21.869805    9.216330     2  3700
3703  3702  H    -17.275140  -22.245773    9.915023     2  3700
3704  3703  O     -3.353058  -10.669905   15.008333     1  3704  3705
3705  3704  H     -3.756681  -10.005348   15.566618     2  3703
3706  3705  H     -3.201227  -10.223540   14.175303     2  3703
3707  3706  O    -19.088066   -5.775215   25.791877     1  3707  3708
3708  3707  H    -18.151685   -5.963384   25.855228     2  3706
3709  3708  H    -19.514370   -6.608797   25.990972     2  3706
3710  3709  O     -0.643235  -17.412217   13.415806     1  3710  3711
3711  3710  H     -1.208545  -17.722687   14.123100     2  3709
3712  3711  H     -0.437027  -18.198664   12.910622     2  3709
3713  3712  O     22.983519    4.369959  -23.651439     1  3713  3714
3714  3713  H     23.536081    5.011783  -23.205378     2  3712
3715  3714  H     22.664679    4.827303  -24.429519     2  3712
3716  3715  O    -23.811530   -4.290663    6.260200     1  3716  3717
3717  3716  H    -24.652047   -4.705232    6.454867     2  3715
3718  3717  H    -23.740749   -3.580522    6.898104     2  3715
3719  3718  O      7.018658  -26.147558   16.334769     1  3719  3720
3720  3719  H      6.901817  -26.993151   15.901695     2  3718
3721  3720  H      6.184292  -25.986204   16.775258     2  3718
3722  3721  O     15.099206  -28.145647  -11.222098     1  3722  3723
3723  3722  H     15.897203  -28.648566  -11.059292     2  3721
3724  3723  H     15.397237  -27.238748  -11.292407     2  3721
3725  3724  O     -6.078543   -7.457093    6.615475     1  3725  3726
3726  3725  H     -5.416776   -6.765506    6.617162     2  3724
3727  3726  H     -6.547209   -7.342810    7.442229     2  3724
3728  3727  O    -33.746023   13.801411   -5.565556     1  3728  3729
3729  3728  H    -33.614487   12.897176   -5.280445     2  3727
3730  3729  H    -34.303312   13.730038   -6.340518     2  3727
3731  3730  O     -8.580433   -8.080969   -4.793046     1  3731  3732
3732  3731  H     -7.649237   -7.883606   -4.692283     2  3730
3733  3732  H     -8.931978   -8.040308   -3.903667     2  3730
3734  3733  O     -8.424766   -6.886889   29.646134     1  3734  3735
3735  3734  H     -7.584148   -7.340868   29.587010     2  3733
3736  3735  H     -9.051188   -7.488383   29.243601     2  3733
3737  3736  O     23.565145    5.535972  -18.358957     1  3737  3738
3738  3737  H     22.704951    5.687387  -17.967330     2  3736
3739  3738  H     23.489836    4.679569  -18.779828     2  3736
3740  3739  O    -16.657865   -5.760265   30.597331     1  3740  3741
3741  3740  H    -16.110865   -5.730387   29.812391     2  3739
3742  3741  H    -17.507770   -5.426229   30.310427     2  3739
3743  3742  O     32.712032    1.883407    0.700557     1  3743  3744
3744  3743  H     32.635747    1.957435    1.651836     2  3742
3745  3744  H     33.484041    2.404725    0.480416     2  3742
3746  3745  O     -1.327061  -22.918717   10.953392     1  3746  3747
3747  3746  H     -2.025163  -22.267035   11.018159     2  3745
3748  3747  H     -1.615546  -23.636299   11.517382     2  3745
3749  3748  O    -11.916542   -4.973761   30.004247     1  3749  3750
3750  3749  H    -12.536689   -4.501255   29.448921     2  3748
3751  3750  H    -11.236674   -4.330795   30.205756     2  3748
3752  3751  O     -8.977320  -15.144100   17.709709     1  3752  3753
3753  3752  H     -8.807259  -16.072733   17.551751     2  3751
3754  3753  H     -8.264812  -14.689771   17.260098     2  3751
3755  3754  O    -12.747830   -3.092388    7.760694     1  3755  3756
3756  3755  H    -12.175143   -3.319193    8.493375     2  3754
3757  3756  H    -13.610730   -2.974956    8.157988     2  3754
3758  3757  O    -18.498157   -5.261651    0.775686     1  3758  3759
3759  3758  H    -18.551866   -4.520970    1.379621     2  3757
3760  3759  H    -18.980456   -4.974551    0.000320     2  3757
3761  3760  O     -1.315543  -20.442412   27.707928     1  3761  3762
3762  3761  H     -0.777323  -20.225412   28.469152     2  3760
3763  3762  H     -1.205624  -19.698057   27.116248     2  3760
3764  3763  O     -0.544153  -28.792633   -2.263551     1  3764  3765
3765  3764  H      0.322162  -29.144372   -2.058589     2  3763
3766  3765  H     -0.910783  -28.547501   -1.414007     2  3763
3767  3766  O     -7.928996  -34.189604    5.033942     1  3767  3768
3768  3767  H     -8.449129  -33.563894    5.538104     2  3766
3769  3768  H     -8.570322  -34.662486    4.503550     2  3766
3770  3769  O     -0.875068   -9.574968   11.916806     1  3770  3771
3771  3770  H     -0.087349   -9.080492   11.690477     2  3769
3772  3771  H     -1.232106   -9.856324   11.074432     2  3769
3773  3772  O    -17.930579  -20.821323   14.522984     1  3773  3774
3774  3773  H    -17.190256  -20.229139   14.390808     2  3772
3775  3774  H    -18.599173  -20.279769   14.942428     2  3772
3776  3775  O    -11.495768   -4.527987    5.779131     1  3776  3777
3777  3776  H    -12.100265   -5.147477    6.187844     2  3775
3778  3777  H    -11.621842   -3.713262    6.265505     2  3775
3779  3778  O      0.145421   33.637621   19.107417     1  3779  3780
3780  3779  H     -0.419969   32.905816   19.354452     2  3778
3781  3780  H     -0.431517   34.237797   18.635016     2  3778
3782  3781  O    -14.104895   -8.948575   30.209045     1  3782  3783
3783  3782  H    -14.016210   -9.803842   30.629623     2  3781
3784  3783  H    -14.269572   -9.150041   29.287891     2  3781
3785  3784  O     -0.540268  -25.011805    0.421011     1  3785  3786
3786  3785  H     -0.677964  -24.814549   -0.505467     2  3784
3787  3786  H     -1.183893  -25.691842    0.619827     2  3784
3788  3787  O     -7.095076   -7.408612   13.442002     1  3788  3789
3789  3788  H     -6.720319   -7.379162   12.561705     2  3787
3790  3789  H     -7.191663   -6.489854   13.692572     2  3787
3791  3790  O    -12.154332   -9.780523   25.910125     1  3791  3792
3792  3791  H    -12.658540  -10.309990   25.292331     2  3790
3793  3792  H    -11.366735   -9.532036   25.426207     2  3790
3794  3793  O     -4.182178  -26.533908    8.958492     1  3794  3795
3795  3794  H     -4.601514  -25.912245    8.363577     2  3793
3796  3795  H     -4.416368  -27.394340    8.610580     2  3793
3797  3796  O     -9.504693  -28.535964    3.348227     1  3797  3798
3798  3797  H     -9.308535  -29.127918    2.622043     2  3796
3799  3798  H     -9.527655  -27.666148    2.949322     2  3796
3800  3799  O     -7.787882  -19.987622   17.096535     1  3800  3801
3801  3800  H     -7.725759  -20.574431   16.342858     2  3799
3802  3801  H     -6.927786  -19.570657   17.147577     2  3799
3803  3802  O    -17.887371  -11.250580   10.758801     1  3803  3804
3804  3803  H    -18.335556  -10.467373   10.439508     2  3802
3805  3804  H    -17.928734  -11.178790   11.712408     2  3802
3806  3805  O     27.990442   20.618074   -3.292652     1  3806  3807
3807  3806  H     27.476365   19.830571   -3.114341     2  3805
3808  3807  H     28.545021   20.722803   -2.519539     2  3805
3809  3808  O     -6.645290  -27.270855    5.615747     1  3809  3810
3810  3809  H     -7.529389  -27.633432    5.559731     2  3808
3811  3810  H     -6.079725  -28.034307    5.731977     2  3808
3812  3811  O     -8.590469  -19.603177    9.355839     1  3812  3813
3813  3812  H     -9.252533  -19.218684    9.930354     2  3811
3814  3813  H     -8.217996  -18.857081    8.885906     2  3811
3815  3814  O    -17.633273  -24.102422    7.244920     1  3815  3816
3816  3815  H    -16.875012  -23.857755    7.775401     2  3814
3817  3816  H    -17.534725  -25.044260    7.105416     2  3814
3818  3817  O     -2.905908  -22.536389    3.161790     1  3818  3819
3819  3818  H     -3.299780  -21.669426    3.064475     2  3817
3820  3819  H     -2.067266  -22.371958    3.592920     2  3817
3821  3820  O    -15.932195   -0.404242   24.259371     1  3821  3822
3822  3821  H    -16.829217   -0.330952   24.585273     2  3820
3823  3822  H    -16.015025   -0.881705   23.433901     2  3820
3824  3823  O    -10.162448    0.674813    1.067547     1  3824  3825
3825  3824  H    -10.825689    0.451025    0.414660     2  3823
3826  3825  H    -10.598428    1.298087    1.648650     2  3823
3827  3826  O    -21.995362  -12.491955    0.657205     1  3827  3828
3828  3827  H    -21.816846  -12.829084   -0.220694     2  3826
3829  3828  H    -21.886265  -13.249553    1.231987     2  3826
3830  3829  O     -2.892533  -20.510065   10.926995     1  3830  3831
3831  3830  H     -2.878695  -19.887508   10.200041     2  3829
3832  3831  H     -3.412340  -20.076906   11.604051     2  3829
3833  3832  O     35.138517    2.099034   -7.107486     1  3833  3834
3834  3833  H     35.304412    1.537836   -7.864960     2  3832
3835  3834  H     34.668013    1.537612   -6.491319     2  3832
3836  3835  O    -23.196166  -18.476434    8.418854     1  3836  3837
3837  3836  H    -23.190022  -19.117565    7.708119     2  3835
3838  3837  H    -22.410550  -17.949303    8.273347     2  3835
3839  3838  O    -13.181532   -5.719424   20.318063     1  3839  3840
3840  3839  H    -12.952530   -6.276188   19.573884     2  3838
3841  3840  H    -13.296876   -6.328801   21.047164     2  3838
3842  3841  O     -5.847452   -2.729436   -6.910519     1  3842  3843
3843  3842  H     -5.695594   -2.187183   -6.136482     2  3841
3844  3843  H     -6.090957   -2.106902   -7.595639     2  3841
3845  3844  O     -6.147319   -2.093121   22.846895     1  3845  3846
3846  3845  H     -6.839670   -2.592791   23.279575     2  3844
3847  3846  H     -5.422797   -2.712588   22.759945     2  3844
3848  3847  O     -4.778600  -30.119437   -3.840971     1  3848  3849
3849  3848  H     -4.953295  -29.401168   -3.232857     2  3847
3850  3849  H     -4.271934  -30.749663   -3.328785     2  3847
3851  3850  O    -15.445407  -17.903357    5.761855     1  3851  3852
3852  3851  H    -14.659059  -17.947890    5.217884     2  3850
3853  3852  H    -15.832122  -18.776527    5.696609     2  3850
3854  3853  O    -32.968658   -8.432717    4.356623     1  3854  3855
3855  3854  H    -33.331182   -9.237962    4.725932     2  3853
3856  3855  H    -32.740702   -8.663136    3.455970     2  3853
3857  3856  O    -14.110099  -10.942461    4.697840     1  3857  3858
3858  3857  H    -14.659193  -10.439018    5.298899     2  3856
3859  3858  H    -14.728851  -11.350288    4.091989     2  3856
3860  3859  O      0.927880  -30.136304   17.504339     1  3860  3861
3861  3860  H      0.782698  -30.787763   16.818223     2  3859
3862  3861  H      0.623594  -30.560735   18.306523     2  3859
3863  3862  O    -23.411425   -9.167049    5.414867     1  3863  3864
3864  3863  H    -23.965617   -9.903447    5.156369     2  3862
3865  3864  H    -23.005448   -8.874230    4.598981     2  3862
3866  3865  O    -30.850259   -1.233932   10.039938     1  3866  3867
3867  3866  H    -30.710053   -2.176488    9.949591     2  3865
3868  3867  H    -30.007711   -0.893741   10.340959     2  3865
3869  3868  O      1.502935  -17.802926   25.990013     1  3869  3870
3870  3869  H      1.634930  -18.727846   25.781850     2  3868
3871  3870  H      0.910566  -17.808315   26.741878     2  3868
3872  3871  O    -21.581718  -16.501099    7.830173     1  3872  3873
3873  3872  H    -21.660920  -16.024051    8.656238     2  3871
3874  3873  H    -21.819018  -15.860691    7.159504     2  3871
3875  3874  O    -19.495830  -17.256651   14.417303     1  3875  3876
3876  3875  H    -19.734445  -17.474305   13.516236     2  3874
3877  3876  H    -19.929051  -17.924871   14.948372     2  3874
3878  3877  O     12.001324  -29.940145   -8.304302     1  3878  3879
3879  3878  H     11.837330  -30.681875   -8.886688     2  3877
3880  3879  H     12.449329  -30.322097   -7.549560     2  3877
3881  3880  O      6.848527   35.742759  -10.752204     1  3881  3882
3882  3881  H      6.886816   36.352408  -10.015255     2  3880
3883  3882  H      6.943088   34.877801  -10.353284     2  3880
3884  3883  O    -31.194430   -2.408909    5.377926     1  3884  3885
3885  3884  H    -31.203697   -2.270828    4.430784     2  3883
3886  3885  H    -31.864047   -3.075831    5.529785     2  3883
3887  3886  O     -8.340987  -10.320465    6.462375     1  3887  3888
3888  3887  H     -9.242244  -10.607291    6.315069     2  3886
3889  3888  H     -7.862049  -10.629560    5.693408     2  3886
3890  3889  O    -14.937982  -12.267183   19.418286     1  3890  3891
3891  3890  H    -15.714148  -11.737596   19.235706     2  3889
3892  3891  H    -14.574500  -11.891740   20.220255     2  3889
3893  3892  O      3.249330  -24.356829   10.399013     1  3893  3894
3894  3893  H      2.359420  -24.082705   10.177319     2  3892
3895  3894  H      3.285657  -25.279836   10.148077     2  3892
3896  3895  O    -22.141006  -14.702602   16.014917     1  3896  3897
3897  3896  H    -22.793075  -14.002850   16.052139     2  3895
3898  3897  H    -22.484184  -15.381577   16.595823     2  3895
3899  3898  O     -9.626876   -6.054057    3.357198     1  3899  3900
3900  3899  H     -9.666494   -5.186726    3.760184     2  3898
3901  3900  H    -10.224189   -6.589059    3.879903     2  3898
3902  3901  O      1.593583  -11.430594   29.928300     1  3902  3903
3903  3902  H      2.184113  -11.468068   30.680697     2  3901
3904  3903  H      0.722928  -11.324483   30.311618     2  3901
3905  3904  O    -21.979754   -5.862964    5.310156     1  3905  3906
3906  3905  H    -22.158324   -5.959190    4.374697     2  3904
3907  3906  H    -22.660076   -5.267404    5.624325     2  3904
3908  3907  O    -14.458724  -28.179074    4.889110     1  3908  3909
3909  3908  H    -13.573258  -28.226902    4.528703     2  3907
3910  3909  H    -15.025715  -28.095771    4.122420     2  3907
3911  3910  O    -31.356325    0.597786    6.814776     1  3911  3912
3912  3911  H    -31.532377   -0.339183    6.729176     2  3910
3913  3912  H    -31.728181    0.835220    7.664235     2  3910
3914  3913  O    -14.161421   -8.107243   21.501464     1  3914  3915
3915  3914  H    -14.683281   -8.839216   21.830265     2  3913
3916  3915  H    -13.502850   -8.515415   20.939405     2  3913
3917  3916  O    -21.855406   -5.750749    8.521735     1  3917  3918
3918  3917  H    -21.259733   -5.013940    8.385657     2  3916
3919  3918  H    -21.464217   -6.470280    8.026277     2  3916
3920  3919  O     -4.778992   -5.003096    7.575394     1  3920  3921
3921  3920  H     -4.491598   -4.889947    8.481393     2  3919
3922  3921  H     -5.674616   -4.665524    7.563789     2  3919
3923  3922  O     -8.383222   -9.854092   14.126041     1  3923  3924
3924  3923  H     -8.140488   -9.006371   13.753642     2  3922
3925  3924  H     -7.744613  -10.001465   14.823673     2  3922
3926  3925  O    -31.873594   -9.081909    2.034026     1  3926  3927
3927  3926  H    -32.607096   -9.575291    1.666900     2  3925
3928  3927  H    -31.150319   -9.240163    1.427346     2  3925
3929  3928  O     -6.036507   -6.267352    3.930508     1  3929  3930
3930  3929  H     -5.563931   -5.501418    4.256466     2  3928
3931  3930  H     -6.009107   -6.892450    4.654893     2  3928
3932  3931  O    -21.178853   -7.221159   -0.444526     1  3932  3933
3933  3932  H    -20.778428   -7.617852    0.329118     2  3931
3934  3933  H    -20.439280   -6.893061   -0.956009     2  3931
3935  3934  O    -31.273575   -8.232097    9.541326     1  3935  3936
3936  3935  H    -30.532376   -8.087079   10.129395     2  3934
3937  3936  H    -30.937533   -8.831484    8.874962     2  3934
3938  3937  O     -2.681641   -0.978579   33.940967     1  3938  3939
3939  3938  H     -3.048869   -1.051817   33.060052     2  3937
3940  3939  H     -2.688229   -1.874104   34.278936     2  3937
3941  3940  O      2.810913  -13.733435   28.643276     1  3941  3942
3942  3941  H      2.787561  -14.581981   29.085607     2  3940
3943  3942  H      2.265386  -13.164567   29.186434     2  3940
3944  3943  O    -18.691600  -12.948435    7.790352     1  3944  3945
3945  3944  H    -17.926458  -13.114251    7.239632     2  3943
3946  3945  H    -18.495946  -13.395383    8.613874     2  3943
3947  3946  O    -18.359625   -4.354018   19.752685     1  3947  3948
3948  3947  H    -17.427039   -4.365523   19.968049     2  3946
3949  3948  H    -18.392634   -4.051512   18.845143     2  3946
3950  3949  O     -4.166910  -11.182904   25.847673     1  3950  3951
3951  3950  H     -3.544318  -10.804083   26.468240     2  3949
3952  3951  H     -5.026821  -10.958090   26.202981     2  3949
3953  3952  O    -22.102212  -12.936413   11.549682     1  3953  3954
3954  3953  H    -22.956932  -13.005915   11.124412     2  3952
3955  3954  H    -21.857535  -12.016642   11.447770     2  3952
3956  3955  O    -18.974973   -6.912988   19.272623     1  3956  3957
3957  3956  H    -18.685553   -7.060205   18.372182     2  3955
3958  3957  H    -18.375907   -6.247787   19.611533     2  3955
3959  3958  O     -4.114673  -12.319061   10.952716     1  3959  3960
3960  3959  H     -4.937489  -12.046839   11.359042     2  3958
3961  3960  H     -4.329447  -13.133605   10.498159     2  3958
3962  3961  O     -3.184704  -34.325331    4.883126     1  3962  3963
3963  3962  H     -2.562301  -33.632047    5.102681     2  3961
3964  3963  H     -3.606609  -34.541272    5.714749     2  3961
3965  3964  O    -24.956046  -14.368104    3.019211     1  3965  3966
3966  3965  H    -25.689179  -13.930124    2.586866     2  3964
3967  3966  H    -25.351543  -15.121014    3.458460     2  3964
3968  3967  O     31.065556   -9.710473    1.638447     1  3968  3969
3969  3968  H     30.391087   -9.115624    1.310608     2  3967
3970  3969  H     31.861347   -9.449930    1.174695     2  3967
3971  3970  O    -14.765906  -27.123572    8.769535     1  3971  3972
3972  3971  H    -15.150165  -26.792933    9.581479     2  3970
3973  3972  H    -15.514434  -27.264856    8.189900     2  3970
3974  3973  O     -8.777400    2.037662    3.951019     1  3974  3975
3975  3974  H     -9.091748    1.409808    4.601570     2  3973
3976  3975  H     -9.571321    2.355444    3.520979     2  3973
3977  3976  O    -17.256480  -10.330448    5.205950     1  3977  3978
3978  3977  H    -16.999994   -9.817665    4.439465     2  3976
3979  3978  H    -18.211315  -10.375483    5.156009     2  3976
3980  3979  O     -4.129984   -9.525239   17.304381     1  3980  3981
3981  3980  H     -3.337555   -9.013051   17.465474     2  3979
3982  3981  H     -4.064636  -10.264845   17.908486     2  3979
3983  3982  O    -11.892800    8.178657   21.988830     1  3983  3984
3984  3983  H    -12.819708    8.224632   22.223263     2  3982
3985  3984  H    -11.530657    7.511297   22.571681     2  3982
3986  3985  O    -25.108126  -11.035569    3.951270     1  3986  3987
3987  3986  H    -25.408153  -11.943268    3.999225     2  3985
3988  3987  H    -25.295259  -10.768181    3.051427     2  3985
3989  3988  O     -4.408690   -9.053747   20.972554     1  3989  3990
3990  3989  H     -3.961970   -9.745626   21.460382     2  3988
3991  3990  H     -4.392326   -9.352293   20.063250     2  3988
3992  3991  O     -3.228889  -27.403363    4.752506     1  3992  3993
3993  3992  H     -3.766633  -28.163941    4.972921     2  3991
3994  3993  H     -3.823058  -26.816968    4.284172     2  3991
3995  3994  O     -9.733552  -21.477235    6.919170     1  3995  3996
3996  3995  H     -9.071862  -22.104100    7.211465     2  3994
3997  3996  H     -9.248538  -20.663899    6.779608     2  3994
3998  3997  O     -6.257709  -14.170152   29.901965     1  3998  3999
3999  3998  H     -5.683231  -14.858048   30.238128     2  3997
4000  3999  H     -7.138048  -14.447448   30.155619     2  3997
4001  4000  O     -5.644183  -14.570406   10.449657     1  4001  4002
4002  4001  H     -5.937275  -14.465594    9.544481     2  4000
4003  4002  H     -5.934950  -15.448498   10.695911     2  4000
4004  4003  O    -26.290940   -3.776523   18.458773     1  4004  4005
4005  4004  H    -26.596394   -3.241244   19.191170     2  4003
4006  4005  H    -25.336716   -3.762554   18.532883     2  4003
4007  4006  O    -27.449854   -9.509262   13.515781     1  4007  4008
4008  4007  H    -28.216735   -9.934249   13.899854     2  4006
4009  4008  H    -26.990775  -10.212374   13.056312     2  4006
4010  4009  O     15.303763   26.582793   -2.654579     1  4010  4011
4011  4010  H     16.192004   26.254789   -2.514320     2  4009
4012  4011  H     15.045620   26.221479   -3.502545     2  4009
4013  4012  O      1.178926  -14.661789   32.322755     1  4013  4014
4014  4013  H      1.371577  -15.082805   31.484982     2  4012
4015  4014  H      0.223698  -14.606509   32.349512     2  4012
4016  4015  O     -7.863084  -13.132318    2.336771     1  4016  4017
4017  4016  H     -6.933343  -13.278624    2.162396     2  4015
4018  4017  H     -8.297565  -13.336141    1.508572     2  4015
4019  4018  O      2.476522  -15.041281   25.375676     1  4019  4020
4020  4019  H      1.859323  -15.726283   25.118637     2  4018
4021  4020  H      2.301988  -14.897695   26.305812     2  4018
4022  4021  O      0.914735   -7.287281   21.004144     1  4022  4023
4023  4022  H      0.490088   -7.168430   20.154567     2  4021
4024  4023  H      1.817708   -7.522142   20.790340     2  4021
4025  4024  O     -4.911298  -12.059229   30.911741     1  4025  4026
4026  4025  H     -4.847098  -11.371304   30.249269     2  4024
4027  4026  H     -5.309473  -12.798509   30.452226     2  4024
4028  4027  O    -26.104376   -2.355493    5.962933     1  4028  4029
4029  4028  H    -26.112432   -3.147256    5.425086     2  4027
4030  4029  H    -26.997568   -2.016388    5.904218     2  4027
4031  4030  O     -4.527275   -6.800201    1.572309     1  4031  4032
4032  4031  H     -5.220698   -6.691247    2.223096     2  4030
4033  4032  H     -4.913259   -7.364732    0.902568     2  4030
4034  4033  O    -12.057897  -16.543034   14.923190     1  4034  4035
4035  4034  H    -12.016149  -15.762488   15.475673     2  4033
4036  4035  H    -11.488318  -16.342170   14.180582     2  4033
4037  4036  O    -31.708850   -2.218314    2.645587     1  4037  4038
4038  4037  H    -32.593134   -2.578580    2.712536     2  4036
4039  4038  H    -31.839686   -1.310316    2.372360     2  4036
4040  4039  O     33.936550   -5.225820   -3.067383     1  4040  4041
4041  4040  H     33.773824   -4.295321   -2.912713     2  4039
4042  4041  H     34.887977   -5.292884   -3.148143     2  4039
4043  4042  O     29.273044  -13.324041    4.861661     1  4043  4044
4044  4043  H     29.436204  -12.406895    5.081784     2  4042
4045  4044  H     28.743159  -13.654367    5.587152     2  4042
4046  4045  O     30.013684   20.979670   -1.098608     1  4046  4047
4047  4046  H     29.398427   20.263076   -0.943094     2  4045
4048  4047  H     29.985678   21.498714   -0.294842     2  4045
4049  4048  O      2.325077  -15.494973   10.934249     1  4049  4050
4050  4049  H      1.488481  -15.144671   11.240237     2  4048
4051  4050  H      2.212972  -15.592493    9.988652     2  4048
4052  4051  O    -15.586826  -19.167915   14.928351     1  4052  4053
4053  4052  H    -15.692838  -18.221793   14.829124     2  4051
4054  4053  H    -15.099334  -19.437718   14.150026     2  4051
4055  4054  O    -18.835980    0.541411   16.800715     1  4055  4056
4056  4055  H    -18.867909    0.583325   17.756464     2  4054
4057  4056  H    -17.964545    0.866949   16.575199     2  4054
4058  4057  O    -21.614586   -7.972502   22.182821     1  4058  4059
4059  4058  H    -22.335865   -7.563083   22.660696     2  4057
4060  4059  H    -21.990889   -8.775208   21.821864     2  4057
4061  4060  O    -10.391329  -17.560770    8.609786     1  4061  4062
4062  4061  H    -10.844978  -17.019911    9.256243     2  4060
4063  4062  H     -9.660984  -17.017965    8.312819     2  4060
4064  4063  O    -18.012619  -22.001910   11.907362     1  4064  4065
4065  4064  H    -17.925812  -22.950393   12.002631     2  4063
4066  4065  H    -18.239004  -21.692346   12.784375     2  4063
4067  4066  O    -24.975400  -12.653277   -5.483728     1  4067  4068
4068  4067  H    -25.146384  -13.561287   -5.233701     2  4066
4069  4068  H    -25.664596  -12.444113   -6.114196     2  4066
4070  4069  O    -19.284003   -2.143182   20.997409     1  4070  4071
4071  4070  H    -18.495744   -2.102278   21.538893     2  4069
4072  4071  H    -19.109839   -2.847309   20.372827     2  4069
4073  4072  O    -34.468904    4.329660    4.819695     1  4073  4074
4074  4073  H    -34.000012    3.680419    4.295426     2  4072
4075  4074  H    -35.334653    4.384902    4.415146     2  4072
4076  4075  O    -14.818935  -10.854188   -1.100367     1  4076  4077
4077  4076  H    -15.730687  -10.717474   -0.842980     2  4075
4078  4077  H    -14.380246  -11.126342   -0.294317     2  4075
4079  4078  O     -3.292056  -14.237039  -35.699980     1  4079  4080
4080  4079  H     -2.729182  -14.975539  -35.467551     2  4078
4081  4080  H     -2.755568  -13.700841  -36.283851     2  4078
4082  4081  O    -15.261166  -14.340609    4.773648     1  4082  4083
4083  4082  H    -15.418424  -13.936302    5.626900     2  4081
4084  4083  H    -14.470653  -14.865619    4.898891     2  4081
4085  4084  O      1.544890  -10.326061    5.600688     1  4085  4086
4086  4085  H      1.393835  -11.244219    5.825188     2  4084
4087  4086  H      1.211141   -9.837054    6.352828     2  4084
4088  4087  O     -6.109524  -14.494803    7.622498     1  4088  4089
4089  4088  H     -5.406811  -14.883351    7.101484     2  4087
4090  4089  H     -6.786213  -14.270767    6.983646     2  4087
4091  4090  O    -14.647216    3.086337   34.721209     1  4091  4092
4092  4091  H    -14.505015    3.520075   33.879851     2  4090
4093  4092  H    -14.717869    2.156978   34.503192     2  4090
4094  4093  O    -34.333328  -10.464093    1.772318     1  4094  4095
4095  4094  H    -34.310022   -9.954635    0.962293     2  4093
4096  4095  H    -35.175917  -10.244413    2.169832     2  4093
4097  4096  O    -32.433457  -15.355988    5.443336     1  4097  4098
4098  4097  H    -31.747275  -14.697343    5.335755     2  4096
4099  4098  H    -33.044647  -14.965941    6.068270     2  4096
4100  4099  O     -3.578668  -10.781939   22.863205     1  4100  4101
4101  4100  H     -3.700293  -11.029814   23.779718     2  4099
4102  4101  H     -3.589203  -11.612019   22.386667     2  4099
4103  4102  O     -6.369314  -12.254630   18.901057     1  4103  4104
4104  4103  H     -5.790835  -11.998439   19.619360     2  4102
4105  4104  H     -7.132792  -12.637925   19.332820     2  4102
4106  4105  O    -16.036077  -16.660237   14.555419     1  4106  4107
4107  4106  H    -15.957947  -15.789171   14.166354     2  4105
4108  4107  H    -16.757247  -16.580415   15.179738     2  4105
4109  4108  O    -21.132651   -8.876220   18.449773     1  4109  4110
4110  4109  H    -20.863643   -9.289714   17.629475     2  4108
4111  4110  H    -20.659129   -8.044505   18.465851     2  4108
4112  4111  O    -27.253072   -3.222583   11.789725     1  4112  4113
4113  4112  H    -26.396643   -2.891361   12.060007     2  4111
4114  4113  H    -27.625985   -2.518738   11.258904     2  4111
4115  4114  O    -19.969287  -14.405892    3.254584     1  4115  4116
4116  4115  H    -19.905928  -14.908747    2.442577     2  4114
4117  4116  H    -19.128485  -13.953556    3.322967     2  4114
4118  4117  O      6.931534   32.967714  -12.982575     1  4118  4119
4119  4118  H      6.753668   32.779592  -12.061052     2  4117
4120  4119  H      7.802413   33.364954  -12.982670     2  4117
4121  4120  O    -18.123241  -12.884048   21.693676     1  4121  4122
4122  4121  H    -18.344645  -13.688665   22.162507     2  4120
4123  4122  H    -18.103578  -13.141090   20.771844     2  4120
4124  4123  O      1.436127  -21.020359   25.087090     1  4124  4125
4125  4124  H      1.747456  -20.728393   24.230316     2  4123
4126  4125  H      1.516006  -21.973816   25.059321     2  4123
4127  4126  O    -27.359335   -2.546826   21.053471     1  4127  4128
4128  4127  H    -28.158993   -2.276976   21.505090     2  4126
4129  4128  H    -26.670840   -2.461591   21.712972     2  4126
4130  4129  O     -0.222132   -2.211345   26.703607     1  4130  4131
4131  4130  H      0.579838   -2.493905   27.143193     2  4129
4132  4131  H     -0.102467   -2.477143   25.791870     2  4129
4133  4132  O    -12.807295   -4.102509   11.977140     1  4133  4134
4134  4133  H    -12.357729   -4.751935   11.436430     2  4132
4135  4134  H    -12.116548   -3.499668   12.252244     2  4132
4136  4135  O      2.915297  -11.926734   12.404801     1  4136  4137
4137  4136  H      3.628457  -12.535125   12.211170     2  4135
4138  4137  H      3.290306  -11.059957   12.248928     2  4135
4139  4138  O     14.728605    1.270581   34.260473     1  4139  4140
4140  4139  H     15.611239    1.340058   34.624286     2  4138
4141  4140  H     14.791940    1.679467   33.397320     2  4138
4142  4141  O    -22.465834  -20.749831    6.027961     1  4142  4143
4143  4142  H    -21.554021  -20.589899    5.784545     2  4141
4144  4143  H    -22.960622  -20.076960    5.560349     2  4141
4145  4144  O    -23.247766   -7.873529    9.993219     1  4145  4146
4146  4145  H    -22.749949   -7.246466    9.468622     2  4144
4147  4146  H    -24.026271   -8.060651    9.468675     2  4144
4148  4147  O    -24.421090   -5.844314   -4.517797     1  4148  4149
4149  4148  H    -24.152500   -5.839038   -3.599067     2  4147
4150  4149  H    -25.128137   -6.488321   -4.557430     2  4147
4151  4150  O     20.472605    5.085780  -28.007429     1  4151  4152
4152  4151  H     20.016372    4.382247  -27.545775     2  4150
4153  4152  H     21.306425    5.174497  -27.545796     2  4150
4154  4153  O    -22.818052  -11.729499   -3.968987     1  4154  4155
4155  4154  H    -23.652171  -11.912457   -4.401427     2  4153
4156  4155  H    -22.230131  -11.474084   -4.679862     2  4153
4157  4156  O     12.854616   19.991154  -18.589785     1  4157  4158
4158  4157  H     13.226283   20.147621  -17.721676     2  4156
4159  4158  H     11.966748   20.345056  -18.538063     2  4156
4160  4159  O     -4.541232   -3.540500   20.243073     1  4160  4161
4161  4160  H     -4.547277   -4.016123   21.073722     2  4159
4162  4161  H     -5.466296   -3.412010   20.033364     2  4159
4163  4162  O    -10.545101  -29.917592    0.200694     1  4163  4164
4164  4163  H    -10.605658  -30.547187   -0.517758     2  4162
4165  4164  H    -10.633445  -30.447936    0.992630     2  4162
4166  4165  O     14.158650   20.842779  -16.150866     1  4166  4167
4167  4166  H     14.328076   20.219443  -15.444481     2  4165
4168  4167  H     14.017721   21.678078  -15.705169     2  4165
4169  4168  O     -7.224577  -12.759341   33.048742     1  4169  4170
4170  4169  H     -6.886351  -12.792738   32.153913     2  4168
4171  4170  H     -7.545223  -13.645342   33.217327     2  4168
4172  4171  O    -10.045469  -16.893009    4.123959     1  4172  4173
4173  4172  H    -10.674105  -17.595273    3.957008     2  4171
4174  4173  H     -9.201947  -17.339034    4.199880     2  4171
4175  4174  O    -20.172662   -9.520157   13.589484     1  4175  4176
4176  4175  H    -20.577813   -8.684638   13.821847     2  4174
4177  4176  H    -20.807658   -9.942040   13.010670     2  4174
4178  4177  O     -6.048799   -6.825661   21.532499     1  4178  4179
4179  4178  H     -6.183143   -6.718875   20.590809     2  4177
4180  4179  H     -5.532440   -7.627728   21.611821     2  4177
4181  4180  O    -10.793561   -1.448180   -2.727249     1  4181  4182
4182  4181  H    -10.125877   -0.767063   -2.807937     2  4180
4183  4182  H    -10.311285   -2.224500   -2.442699     2  4180
4184  4183  O     -6.155229  -22.831266    2.740490     1  4184  4185
4185  4184  H     -5.701316  -22.410571    3.470702     2  4183
4186  4185  H     -6.859631  -23.331840    3.152165     2  4183
4187  4186  O    -25.518395  -19.403281   -0.507635     1  4187  4188
4188  4187  H    -25.100003  -18.610962   -0.844398     2  4186
4189  4188  H    -25.906419  -19.134390    0.325051     2  4186
4190  4189  O    -13.154664   -1.182187   15.902773     1  4190  4191
4191  4190  H    -13.522458   -1.849393   16.482252     2  4189
4192  4191  H    -12.346509   -0.907268   16.335828     2  4189
4193  4192  O    -18.501080  -18.653482    1.757169     1  4193  4194
4194  4193  H    -18.890280  -19.167735    2.464488     2  4192
4195  4194  H    -17.561987  -18.662986    1.942222     2  4192
4196  4195  O     -5.869151  -18.776994   14.029785     1  4196  4197
4197  4196  H     -4.961933  -18.507861   13.885717     2  4195
4198  4197  H     -6.335442  -17.961158   14.212035     2  4195
4199  4198  O      6.297544   -0.816504   17.271121     1  4199  4200
4200  4199  H      5.791390   -0.231442   17.834807     2  4198
4201  4200  H      7.158005   -0.402223   17.206244     2  4198
4202  4201  O     -0.589181  -15.482077  -34.766520     1  4202  4203
4203  4202  H     -0.305735  -15.910031  -33.958593     2  4201
4204  4203  H     -0.225339  -16.024838  -35.465992     2  4201
4205  4204  O    -15.082364  -14.177006   10.503453     1  4205  4206
4206  4205  H    -16.039238  -14.175984   10.478485     2  4204
4207  4206  H    -14.818313  -14.083158    9.588192     2  4204
4208  4207  O    -15.463886  -11.712645    2.241658     1  4208  4209
4209  4208  H    -15.608231  -10.800039    1.991568     2  4207
4210  4209  H    -14.552434  -11.884933    2.005428     2  4207
4211  4210  O    -13.336051  -12.153149   16.519105     1  4211  4212
4212  4211  H    -14.282986  -12.290914   16.495326     2  4210
4213  4212  H    -13.189979  -11.625222   17.304082     2  4210
4214  4213  O     -4.898595   -5.884359   -1.789109     1  4214  4215
4215  4214  H     -4.021195   -6.240874   -1.650194     2  4213
4216  4215  H     -4.760329   -4.944048   -1.902817     2  4213
4217  4216  O     -1.224670  -17.910540   -2.527965     1  4217  4218
4218  4217  H     -0.814151  -18.555039   -1.951488     2  4216
4219  4218  H     -2.156907  -18.126379   -2.503893     2  4216
4220  4219  O     -6.647886  -12.373410   24.672423     1  4220  4221
4221  4220  H     -7.124327  -13.008810   24.138097     2  4219
4222  4221  H     -6.871059  -12.603088   25.574461     2  4219
4223  4222  O     -9.155386   -8.487375    8.341634     1  4223  4224
4224  4223  H    -10.072989   -8.718809    8.197847     2  4222
4225  4224  H     -8.678098   -8.966171    7.664005     2  4222
4226  4225  O    -18.245012   -1.685333   31.288826     1  4226  4227
4227  4226  H    -18.017232   -2.614790   31.310222     2  4225
4228  4227  H    -18.684740   -1.526718   32.124118     2  4225
4229  4228  O     -1.450480   -3.386607    3.987955     1  4229  4230
4230  4229  H     -1.392110   -3.027440    3.102616     2  4228
4231  4230  H     -1.211151   -2.656835    4.559256     2  4228
4232  4231  O    -10.025755  -23.236714   17.598441     1  4232  4233
4233  4232  H     -9.408895  -22.508548   17.672547     2  4231
4234  4233  H    -10.588110  -23.154172   18.368619     2  4231
4235  4234  O     -7.067124   -3.027383   19.378101     1  4235  4236
4236  4235  H     -6.729698   -3.163681   18.492777     2  4234
4237  4236  H     -7.690658   -3.741578   19.509875     2  4234
4238  4237  O    -15.858489  -11.748776   13.408265     1  4238  4239
4239  4238  H    -16.169001  -10.862677   13.222141     2  4237
4240  4239  H    -14.904183  -11.674522   13.403910     2  4237
4241  4240  O    -28.043516  -20.500825    5.156558     1  4241  4242
4242  4241  H    -27.366206  -20.204064    5.764354     2  4240
4243  4242  H    -27.559466  -20.818673    4.394391     2  4240
4244  4243  O    -26.041279   -9.074646    8.943598     1  4244  4245
4245  4244  H    -25.683929   -8.623618    8.178676     2  4243
4246  4245  H    -26.022260  -10.001731    8.706149     2  4243
4247  4246  O     -5.586049   -7.778819   30.503031     1  4247  4248
4248  4247  H     -5.796374   -6.989576   31.002120     2  4246
4249  4248  H     -5.141401   -7.455801   29.719335     2  4246
4250  4249  O      0.428467  -16.953736   22.322742     1  4250  4251
4251  4250  H     -0.136079  -16.546869   22.979994     2  4249
4252  4251  H      0.492023  -16.302134   21.624454     2  4249
4253  4252  O     -4.778780  -16.452309   26.863693     1  4253  4254
4254  4253  H     -5.529759  -16.252047   27.422404     2  4252
4255  4254  H     -4.340499  -15.610399   26.739876     2  4252
4256  4255  O    -25.535173   -9.915782    1.529364     1  4256  4257
4257  4256  H    -24.670186  -10.004916    1.129257     2  4255
4258  4257  H    -25.773980   -9.000429    1.383309     2  4255
4259  4258  O     -7.861143   -8.438930    2.746735     1  4259  4260
4260  4259  H     -7.231330   -7.783759    3.047264     2  4258
4261  4260  H     -8.687880   -8.182151    3.155150     2  4258
4262  4261  O     -2.313727   -9.463162    2.319671     1  4262  4263
4263  4262  H     -2.512036   -8.676970    2.828401     2  4261
4264  4263  H     -2.330723  -10.174175    2.960298     2  4261
4265  4264  O     17.906372   12.935268  -20.338988     1  4265  4266
4266  4265  H     18.139610   13.645341  -20.937008     2  4264
4267  4266  H     16.954349   12.992773  -20.257887     2  4264
4268  4267  O    -24.476055   -7.570596    7.194905     1  4268  4269
4269  4268  H    -24.203015   -8.175133    6.504821     2  4267
4270  4269  H    -23.844303   -6.852948    7.149062     2  4267
4271  4270  O    -12.093423  -28.079004    3.572221     1  4271  4272
4272  4271  H    -11.285577  -28.578646    3.454007     2  4270
4273  4272  H    -12.538577  -28.139005    2.726958     2  4270
4274  4273  O     -5.172228  -19.246052   17.576109     1  4274  4275
4275  4274  H     -5.295004  -19.572594   18.467472     2  4273
4276  4275  H     -4.244863  -19.394964   17.391579     2  4273
4277  4276  O     -3.504842  -21.891754   28.230048     1  4277  4278
4278  4277  H     -2.934766  -22.199288   28.934795     2  4276
4279  4278  H     -3.039188  -21.145166   27.853214     2  4276
4280  4279  O    -13.619847    1.120048    3.970913     1  4280  4281
4281  4280  H    -14.501182    1.402833    4.214865     2  4279
4282  4281  H    -13.567055    0.212841    4.271610     2  4279
4283  4282  O    -10.407021  -12.689610   30.737247     1  4283  4284
4284  4283  H     -9.958381  -12.756071   29.894314     2  4282
4285  4284  H    -11.238481  -13.144482   30.603098     2  4282
4286  4285  O    -28.905765  -11.138862    7.611925     1  4286  4287
4287  4286  H    -28.157151  -10.785109    7.131647     2  4285
4288  4287  H    -28.564360  -11.920205    8.046869     2  4285
4289  4288  O    -14.598479    0.367882   33.885347     1  4289  4290
4290  4289  H    -14.839346   -0.460708   34.299657     2  4288
4291  4290  H    -13.791312    0.631428   34.327225     2  4288
4292  4291  O    -22.678046  -15.078577    1.481524     1  4292  4293
4293  4292  H    -23.343439  -14.568621    1.943506     2  4291
4294  4293  H    -23.121878  -15.892598    1.243584     2  4291
4295  4294  O     -6.440077   -3.710321   -3.241549     1  4295  4296
4296  4295  H     -5.576130   -3.938059   -3.585005     2  4294
4297  4296  H     -7.044522   -4.283462   -3.713128     2  4294
4298  4297  O    -11.743913   -6.076636   14.782897     1  4298  4299
4299  4298  H    -10.993480   -6.348218   15.311410     2  4297
4300  4299  H    -12.355105   -5.694275   15.412560     2  4297
4301  4300  O    -22.727466  -11.018544    7.592320     1  4301  4302
4302  4301  H    -21.901072  -11.070791    8.072503     2  4300
4303  4302  H    -22.671062  -10.195800    7.106375     2  4300
4304  4303  O     -0.446677  -14.055526   15.990676     1  4304  4305
4305  4304  H     -0.144255  -14.939180   16.200268     2  4303
4306  4305  H      0.021558  -13.825683   15.188079     2  4303
4307  4306  O     -9.370737   -8.871035   24.765961     1  4307  4308
4308  4307  H     -8.553407   -8.764789   24.279222     2  4306
4309  4308  H     -9.102294   -8.889935   25.684553     2  4306
4310  4309  O     -5.234187  -28.944402    8.215228     1  4310  4311
4311  4310  H     -6.134134  -29.136594    7.951813     2  4309
4312  4311  H     -5.028840  -29.610228    8.871535     2  4309
4313  4312  O     17.299912   29.639975   -3.772347     1  4313  4314
4314  4313  H     17.854043   29.023009   -3.294304     2  4312
4315  4314  H     16.654336   29.931360   -3.128487     2  4312
4316  4315  O      1.468533  -11.301524    2.960768     1  4316  4317
4317  4316  H      1.584434  -10.771144    3.749119     2  4315
4318  4317  H      0.645869  -10.991777    2.581937     2  4315
4319  4318  O    -14.400002   -1.705449   11.188464     1  4319  4320
4320  4319  H    -14.747655   -1.496992   12.055594     2  4318
4321  4320  H    -13.838492   -2.467281   11.331815     2  4318
4322  4321  O    -25.423289  -17.172119   11.892786     1  4322  4323
4323  4322  H    -24.933188  -17.924787   11.561843     2  4321
4324  4323  H    -24.864912  -16.804555   12.577872     2  4321
4325  4324  O    -22.937706   -9.779311    0.660749     1  4325  4326
4326  4325  H    -22.490886   -9.307686   -0.042212     2  4324
4327  4326  H    -22.617465  -10.678403    0.587875     2  4324
4328  4327  O      2.562669   21.801805  -28.426424     1  4328  4329
4329  4328  H      2.501979   20.977759  -27.943208     2  4327
4330  4329  H      1.785357   22.293378  -28.161146     2  4327
4331  4330  O    -25.971266  -15.002349   -4.480064     1  4331  4332
4332  4331  H    -26.895079  -14.893626   -4.254276     2  4330
4333  4332  H    -25.522167  -15.051705   -3.636200     2  4330
4334  4333  O     -9.617592   34.884596    5.041334     1  4334  4335
4335  4334  H     -8.812794   34.757259    5.543644     2  4333
4336  4335  H    -10.225037   34.233318    5.392159     2  4333
4337  4336  O    -26.579132  -16.539275   -0.030264     1  4337  4338
4338  4337  H    -26.684403  -16.813730    0.880682     2  4336
4339  4338  H    -27.463366  -16.574218   -0.395149     2  4336
4340  4339  O     -4.728713   -7.140218   28.072879     1  4340  4341
4341  4340  H     -3.883713   -6.820976   27.756193     2  4339
4342  4341  H     -5.232689   -7.314377   27.277952     2  4339
4343  4342  O    -20.021817   -9.835818    4.873495     1  4343  4344
4344  4343  H    -19.792655   -9.994666    3.957807     2  4342
4345  4344  H    -20.927411   -9.527155    4.844180     2  4342
4346  4345  O     15.937512   16.500626  -20.506166     1  4346  4347
4347  4346  H     15.506374   16.173847  -19.716503     2  4345
4348  4347  H     15.305966   16.341642  -21.207669     2  4345
4349  4348  O    -27.814862  -18.530143    1.693801     1  4349  4350
4350  4349  H    -28.242961  -19.378909    1.805873     2  4348
4351  4350  H    -28.497022  -17.962870    1.334511     2  4348
4352  4351  O    -17.703081  -17.305196   10.223208     1  4352  4353
4353  4352  H    -17.747528  -16.357497   10.350180     2  4351
4354  4353  H    -17.555675  -17.414815    9.283800     2  4351
4355  4354  O     -2.414628    0.633945   10.545417     1  4355  4356
4356  4355  H     -2.035984    0.463047    9.683063     2  4354
4357  4356  H     -1.776712    0.276034   11.162826     2  4354
4358  4357  O    -17.916236  -14.171686   10.264202     1  4358  4359
4359  4358  H    -18.637726  -14.367270   10.862057     2  4357
4360  4359  H    -17.772665  -13.230298   10.361198     2  4357
4361  4360  O    -12.756551  -14.290855    1.588596     1  4361  4362
4362  4361  H    -12.308009  -14.812352    0.922951     2  4360
4363  4362  H    -12.178071  -14.325239    2.350443     2  4360
4364  4363  O     -9.490800  -11.862570   12.704228     1  4364  4365
4365  4364  H    -10.298691  -11.507852   12.333122     2  4363
4366  4365  H     -9.199026  -11.195522   13.325635     2  4363
4367  4366  O    -24.305779  -15.240185    6.167016     1  4367  4368
4368  4367  H    -25.179032  -14.849607    6.133695     2  4366
4369  4368  H    -23.796464  -14.744289    5.525988     2  4366
4370  4369  O     -5.394703  -23.616364   16.915091     1  4370  4371
4371  4370  H     -5.074757  -23.244309   17.736944     2  4369
4372  4371  H     -5.724079  -22.864130   16.423269     2  4369
4373  4372  O    -30.766989    2.065873   16.978507     1  4373  4374
4374  4373  H    -31.039029    2.002564   17.894049     2  4372
4375  4374  H    -30.984296    1.212203   16.604000     2  4372
4376  4375  O    -28.397141  -12.978203    9.740388     1  4376  4377
4377  4376  H    -29.229580  -13.357424   10.022293     2  4375
4378  4377  H    -27.732284  -13.486710   10.204733     2  4375
4379  4378  O     -9.691865  -14.258524   13.886321     1  4379  4380
4380  4379  H     -9.585882  -13.482359   13.336260     2  4378
4381  4380  H     -9.086321  -14.120938   14.614756     2  4378
4382  4381  O     21.383478   16.103006  -15.619991     1  4382  4383
4383  4382  H     21.687949   16.945684  -15.283206     2  4381
4384  4383  H     21.790920   16.028059  -16.482897     2  4381
4385  4384  O     -1.942497  -12.615999   28.966576     1  4385  4386
4386  4385  H     -1.936324  -13.071077   28.124496     2  4384
4387  4386  H     -2.587809  -11.917545   28.857182     2  4384
4388  4387  O    -19.539645  -28.887146    1.764042     1  4388  4389
4389  4388  H    -19.343000  -28.224966    2.426672     2  4387
4390  4389  H    -18.959628  -29.618482    1.976080     2  4387
4391  4390  O      4.223998   -7.826143   32.063074     1  4391  4392
4392  4391  H      3.508618   -8.458862   32.127345     2  4390
4393  4392  H      5.018183   -8.350686   32.164839     2  4390
4394  4393  O      2.291733  -32.191305  -19.472811     1  4394  4395
4395  4394  H      2.658521  -32.248978  -18.590557     2  4393
4396  4395  H      2.808195  -32.810721  -19.988389     2  4393
4397  4396  O     -8.069018  -20.156041    3.463796     1  4397  4398
4398  4397  H     -8.256534  -19.895718    4.365628     2  4396
4399  4398  H     -7.177138  -20.502222    3.494449     2  4396
4400  4399  O     -0.062683   -7.668140    5.316710     1  4400  4401
4401  4400  H     -0.122123   -7.475338    6.252406     2  4399
4402  4401  H     -0.892231   -8.097168    5.106912     2  4399
4403  4402  O    -21.391978  -16.786069   12.098861     1  4403  4404
4404  4403  H    -21.714403  -16.335647   11.318224     2  4402
4405  4404  H    -21.942646  -16.458106   12.809802     2  4402
4406  4405  O     -0.724879  -21.668945    4.456077     1  4406  4407
4407  4406  H     -0.574099  -21.415069    3.545559     2  4405
4408  4407  H     -0.007474  -21.260930    4.940934     2  4405
4409  4408  O    -12.189231  -14.019681   10.491436     1  4409  4410
4410  4409  H    -13.139669  -13.906485   10.500652     2  4408
4411  4410  H    -12.055862  -14.945703   10.693742     2  4408
4412  4411  O    -17.314923   -3.600094   25.813035     1  4412  4413
4413  4412  H    -17.432274   -3.037106   26.578218     2  4411
4414  4413  H    -18.201672   -3.873049   25.577658     2  4411
4415  4414  O    -18.623358   -0.485160    8.607395     1  4415  4416
4416  4415  H    -18.276827   -0.288466    9.477717     2  4414
4417  4416  H    -18.354698    0.258802    8.068345     2  4414
4418  4417  O      5.150084  -10.609044   15.846526     1  4418  4419
4419  4418  H      4.277087  -10.997792   15.791897     2  4417
4420  4419  H      5.111870  -10.040384   16.615549     2  4417
4421  4420  O    -28.626152   -7.054965   12.601442     1  4421  4422
4422  4421  H    -28.108297   -7.797727   12.911866     2  4420
4423  4422  H    -28.739781   -7.216363   11.664815     2  4420
4424  4423  O    -33.190892   -6.185671    1.880048     1  4424  4425
4425  4424  H    -33.173259   -7.040414    2.310555     2  4423
4426  4425  H    -33.268807   -5.557067    2.597696     2  4423
4427  4426  O    -19.951927  -10.426522    7.615232     1  4427  4428
4428  4427  H    -19.780204  -11.343640    7.828861     2  4426
4429  4428  H    -19.693646  -10.341464    6.697470     2  4426
4430  4429  O    -23.990239   -5.851632   14.256955     1  4430  4431
4431  4430  H    -23.647486   -5.073891   14.697261     2  4429
4432  4431  H    -24.931117   -5.691273   14.184402     2  4429
4433  4432  O     -8.661488  -12.892065   20.402180     1  4433  4434
4434  4433  H     -9.210588  -12.978928   19.622965     2  4432
4435  4434  H     -8.652472  -13.767901   20.788265     2  4432
4436  4435  O    -26.469186  -16.653459    3.940963     1  4436  4437
4437  4436  H    -26.910692  -17.458387    3.670047     2  4435
4438  4437  H    -26.858719  -16.439771    4.788803     2  4435
4439  4438  O     -4.103478  -14.013400   25.287665     1  4439  4440
4440  4439  H     -4.399692  -14.300643   24.423963     2  4438
4441  4440  H     -4.344704  -13.087999   25.328600     2  4438
4442  4441  O    -15.805256  -28.229999    2.113932     1  4442  4443
4443  4442  H    -16.075029  -28.408000    1.212949     2  4441
4444  4443  H    -15.802402  -29.088322    2.537612     2  4441
4445  4444  O    -14.313591   -9.464353   11.319703     1  4445  4446
4446  4445  H    -14.030828   -8.972974   12.090951     2  4444
4447  4446  H    -14.840622   -8.841997   10.818563     2  4444
4448  4447  O     -0.223337  -14.035017    4.615640     1  4448  4449
4449  4448  H      0.003863  -13.911291    3.694063     2  4447
4450  4449  H      0.583845  -14.351261    5.021445     2  4447
4451  4450  O    -11.372497   -6.776465   10.384916     1  4451  4452
4452  4451  H    -10.793135   -6.016908   10.445286     2  4450
4453  4452  H    -10.851305   -7.503514   10.725487     2  4450
4454  4453  O     -9.524259  -34.325064    2.291594     1  4454  4455
4455  4454  H     -9.187519  -35.206347    2.129800     2  4453
4456  4455  H    -10.476061  -34.423627    2.267291     2  4453
4457  4456  O    -15.942799  -10.323469    9.020595     1  4457  4458
4458  4457  H    -16.758895  -10.545449    9.468861     2  4456
4459  4458  H    -15.338864  -10.087207    9.724637     2  4456
4460  4459  O     -0.639775  -36.150921  -17.250265     1  4460  4461
4461  4460  H     -1.024819  -35.353893  -16.885959     2  4459
4462  4461  H     -0.853968  -36.833364  -16.614164     2  4459
4463  4462  O    -11.611807   -8.623597   -3.805597     1  4463  4464
4464  4463  H    -12.152614   -9.407632   -3.710470     2  4462
4465  4464  H    -10.978824   -8.680375   -3.089818     2  4462
4466  4465  O      5.923395   22.578285  -24.177705     1  4466  4467
4467  4466  H      6.682965   22.300691  -23.665625     2  4465
4468  4467  H      5.377402   21.794647  -24.241230     2  4465
4469  4468  O    -16.787193   -8.056043    3.148654     1  4469  4470
4470  4469  H    -16.088048   -8.382509    2.582220     2  4468
4471  4470  H    -16.450219   -7.229166    3.493552     2  4468
4472  4471  O    -26.130848  -12.457450    0.804139     1  4472  4473
4473  4472  H    -26.132629  -11.562037    1.142464     2  4471
4474  4473  H    -25.552797  -12.424837    0.041889     2  4471
4475  4474  O    -25.320130  -11.671336    7.832205     1  4475  4476
4476  4475  H    -24.381705  -11.551007    7.686907     2  4474
4477  4476  H    -25.617215  -12.176975    7.075699     2  4474
4478  4477  O    -25.339492  -16.676708    8.416601     1  4478  4479
4479  4478  H    -24.589587  -17.252338    8.566684     2  4477
4480  4479  H    -24.968868  -15.907708    7.983578     2  4477
4481  4480  O    -32.431240  -14.938591    1.910891     1  4481  4482
4482  4481  H    -33.089780  -15.528305    2.278035     2  4480
4483  4482  H    -32.417843  -15.145761    0.976476     2  4480
4484  4483  O     -0.068699   -9.038353   14.604197     1  4484  4485
4485  4484  H      0.883670   -9.133568   14.591569     2  4483
4486  4485  H     -0.363223   -9.464937   13.799515     2  4483
4487  4486  O    -36.164419  -10.123307    5.704547     1  4487  4488
4488  4487  H    -36.305267  -10.422792    6.602714     2  4486
4489  4488  H    -35.249743  -10.337424    5.520828     2  4486
4490  4489  O      4.456130   23.555238  -26.342999     1  4490  4491
4491  4490  H      4.754646   23.386645  -25.449301     2  4489
4492  4491  H      4.663537   22.752176  -26.820812     2  4489
4493  4492  O     -2.537915  -17.085112    1.799783     1  4493  4494
4494  4493  H     -2.490078  -16.357158    1.180084     2  4492
4495  4494  H     -3.398368  -17.475181    1.645840     2  4492
4496  4495  O     -4.800927  -12.678401   14.075513     1  4496  4497
4497  4496  H     -4.288850  -11.981836   14.486374     2  4495
4498  4497  H     -5.448170  -12.217531   13.541746     2  4495
4499  4498  O     14.969212  -30.083175   -8.120282     1  4499  4500
4500  4499  H     14.276932  -29.476970   -8.383901     2  4498
4501  4500  H     15.588611  -30.072089   -8.849976     2  4498
4502  4501  O      3.919437   20.626353  -24.506551     1  4502  4503
4503  4502  H      3.046665   21.015498  -24.561925     2  4501
4504  4503  H      4.032114   20.170095  -25.340436     2  4501
4505  4504  O    -18.863147   -4.065318   28.171576     1  4505  4506
4506  4505  H    -18.778927   -4.256782   29.105642     2  4504
4507  4506  H    -18.914908   -4.925111   27.754072     2  4504
4508  4507  O     14.890882   25.610637  -10.215444     1  4508  4509
4509  4508  H     14.660683   24.906590   -9.609180     2  4507
4510  4509  H     14.589195   25.300356  -11.069225     2  4507
4511  4510  O    -10.301753   -3.387952   27.268645     1  4511  4512
4512  4511  H     -9.423463   -3.768465   27.275611     2  4510
4513  4512  H    -10.153785   -2.442408   27.285450     2  4510
4514  4513  O     11.196505   15.333676  -25.364422     1  4514  4515
4515  4514  H     11.784369   16.086625  -25.303481     2  4513
4516  4515  H     11.766284   14.603231  -25.605325     2  4513
4517  4516  O    -25.392112   -6.528154   -0.301731     1  4517  4518
4518  4517  H    -25.272483   -5.981083    0.474565     2  4516
4519  4518  H    -24.732293   -6.214641   -0.920261     2  4516
4520  4519  O     -6.565762  -17.695663   -1.410260     1  4520  4521
4521  4520  H     -6.678982  -16.782634   -1.674436     2  4519
4522  4521  H     -6.997018  -18.200281   -2.099905     2  4519
4523  4522  O     35.345465    0.002931    1.133100     1  4523  4524
4524  4523  H     35.215372   -0.795256    0.621041     2  4522
4525  4524  H     35.019407   -0.216113    2.005991     2  4522
4526  4525  O      2.764051    5.074354   21.592275     1  4526  4527
4527  4526  H      2.204442    4.805095   20.863874     2  4525
4528  4527  H      3.173020    5.886483   21.293238     2  4525
4529  4528  O    -14.993236   -8.428713   24.755779     1  4529  4530
4530  4529  H    -15.290697   -7.533750   24.919459     2  4528
4531  4530  H    -14.521742   -8.674260   25.551790     2  4528
4532  4531  O      0.855029    1.807992   18.439545     1  4532  4533
4533  4532  H      0.888520    1.311520   19.257240     2  4531
4534  4533  H      0.522983    1.184471   17.793635     2  4531
4535  4534  O    -16.388934  -32.584035    5.054598     1  4535  4536
4536  4535  H    -16.267607  -32.856915    5.964020     2  4534
4537  4536  H    -15.749411  -31.883362    4.926926     2  4534
4538  4537  O    -24.264206  -12.749053   10.055855     1  4538  4539
4539  4538  H    -24.813258  -13.491259   10.308650     2  4537
4540  4539  H    -24.683261  -12.397025    9.270552     2  4537
4541  4540  O    -18.682163   -4.008290   17.208139     1  4541  4542
4542  4541  H    -17.859713   -4.180774   16.749820     2  4540
4543  4542  H    -19.342544   -4.482244   16.702673     2  4540
4544  4543  O    -26.039751  -12.528145   14.367906     1  4544  4545
4545  4544  H    -25.799219  -12.107628   13.542351     2  4543
4546  4545  H    -26.845581  -13.004749   14.168607     2  4543
4547  4546  O    -18.730488    4.421810   15.781409     1  4547  4548
4548  4547  H    -19.280590    5.017953   15.273242     2  4546
4549  4548  H    -18.013977    4.970135   16.101071     2  4546
4550  4549  O    -25.030743  -15.012929   -1.879494     1  4550  4551
4551  4550  H    -25.651128  -15.416618   -1.272542     2  4549
4552  4551  H    -25.158369  -14.071543   -1.762295     2  4549
4553  4552  O     15.283403   13.557149  -20.174731     1  4553  4554
4554  4553  H     14.993280   14.277043  -19.614542     2  4552
4555  4554  H     14.650982   13.542183  -20.893099     2  4552
4556  4555  O    -19.893175  -10.721184    2.460251     1  4556  4557
4557  4556  H    -20.399200  -11.447439    2.095937     2  4555
4558  4557  H    -19.948342  -10.033561    1.796653     2  4555
4559  4558  O    -30.734621   -3.128271   -2.899994     1  4559  4560
4560  4559  H    -30.354962   -2.810020   -3.719022     2  4558
4561  4560  H    -29.982304   -3.266833   -2.324625     2  4558
4562  4561  O     -7.961842   -9.685446    0.279689     1  4562  4563
4563  4562  H     -8.226377   -9.576743    1.193163     2  4561
4564  4563  H     -7.385803   -8.940873    0.106426     2  4561
4565  4564  O     -3.567772   -3.775299   -3.568948     1  4565  4566
4566  4565  H     -3.538270   -2.924500   -4.006558     2  4564
4567  4566  H     -2.720975   -4.175864   -3.765705     2  4564
4568  4567  O    -18.672406   -6.729380    8.521968     1  4568  4569
4569  4568  H    -18.411817   -5.877821    8.872925     2  4567
4570  4569  H    -18.017902   -6.922825    7.850823     2  4567
4571  4570  O    -18.048580  -19.055778   12.195866     1  4571  4572
4572  4571  H    -18.063377  -18.510691   11.409169     2  4570
4573  4572  H    -18.003286  -19.952969   11.865368     2  4570
4574  4573  O     -3.834266  -15.116457   33.916297     1  4574  4575
4575  4574  H     -3.541273  -14.270896   34.256024     2  4573
4576  4575  H     -4.586442  -15.346632   34.461717     2  4573
4577  4576  O     -4.098639   -9.012457   -3.028123     1  4577  4578
4578  4577  H     -3.279407   -8.523759   -3.107272     2  4576
4579  4578  H     -4.323362   -8.955387   -2.099428     2  4576
4580  4579  O    -11.842478   -2.715289    0.207215     1  4580  4581
4581  4580  H    -11.695586   -2.672674    1.152116     2  4579
4582  4581  H    -10.976101   -2.884393   -0.162955     2  4579
4583  4582  O    -10.623829    0.255788    9.370742     1  4583  4584
4584  4583  H    -10.446088   -0.440710   10.002826     2  4582
4585  4584  H    -10.568612    1.063350    9.881649     2  4582
4586  4585  O     -6.053009    0.441103    1.638969     1  4586  4587
4587  4586  H     -5.636702    0.198504    2.466052     2  4585
4588  4587  H     -5.910536    1.384849    1.566333     2  4585
4589  4588  O    -14.698436   -7.022586   -0.692073     1  4589  4590
4590  4589  H    -14.460613   -7.839719   -0.253935     2  4588
4591  4590  H    -13.863095   -6.648731   -0.972555     2  4588
4592  4591  O     -2.414581   -4.263594   16.615567     1  4592  4593
4593  4592  H     -1.700321   -4.850212   16.366679     2  4591
4594  4593  H     -3.011979   -4.282169   15.867903     2  4591
4595  4594  O    -30.975907    1.098279    4.264218     1  4595  4596
4596  4595  H    -30.032563    1.014251    4.125392     2  4594
4597  4596  H    -31.079748    1.094213    5.215761     2  4594
4598  4597  O     -3.556404  -14.460227   19.072508     1  4598  4599
4599  4598  H     -4.436241  -14.757676   19.304119     2  4597
4600  4599  H     -3.466026  -14.677695   18.144731     2  4597
4601  4600  O     -7.199258   -7.015728   -0.478535     1  4601  4602
4602  4601  H     -7.666244   -6.273946   -0.093938     2  4600
4603  4602  H     -6.569394   -6.617425   -1.079249     2  4600
4604  4603  O    -22.223851   -2.163813   14.597005     1  4604  4605
4605  4604  H    -21.464544   -1.697309   14.946372     2  4603
4606  4605  H    -22.423288   -2.826705   15.258088     2  4603
4607  4606  O    -11.768144  -20.129847    8.393833     1  4607  4608
4608  4607  H    -11.497719  -19.232273    8.587384     2  4606
4609  4608  H    -10.954057  -20.584329    8.177177     2  4606
4610  4609  O    -15.214568   -5.047317   -3.585796     1  4610  4611
4611  4610  H    -14.711966   -5.303929   -2.812638     2  4609
4612  4611  H    -15.691937   -4.263925   -3.312579     2  4609
4613  4612  O      7.331323   24.921310  -21.815278     1  4613  4614
4614  4613  H      7.733288   25.121272  -20.969896     2  4612
4615  4614  H      7.363471   23.966610  -21.876475     2  4612
4616  4615  O     -5.879022  -16.416721   16.670760     1  4616  4617
4617  4616  H     -5.560220  -17.261735   16.987855     2  4615
4618  4617  H     -5.090168  -15.952120   16.391320     2  4615
4619  4618  O    -14.515887   -8.305846   18.131453     1  4619  4620
4620  4619  H    -13.959850   -8.946188   18.575319     2  4618
4621  4620  H    -14.916188   -8.793626   17.411687     2  4618
4622  4621  O    -35.637846   -2.557294   -4.396273     1  4622  4623
4623  4622  H    -34.897756   -2.846285   -4.930109     2  4621
4624  4623  H    -36.366365   -3.111671   -4.675841     2  4621
4625  4624  O     -8.215642   -3.569662   24.203024     1  4625  4626
4626  4625  H     -8.226736   -3.808293   25.129935     2  4624
4627  4626  H     -9.129324   -3.639337   23.926321     2  4624
4628  4627  O     -0.869204   26.475632  -24.538142     1  4628  4629
4629  4628  H     -1.288414   27.214727  -24.097421     2  4627
4630  4629  H     -0.837592   26.732305  -25.459745     2  4627
4631  4630  O     -2.892802   -8.394025    8.705731     1  4631  4632
4632  4631  H     -2.475276   -9.226907    8.925301     2  4630
4633  4632  H     -3.717599   -8.403663    9.191373     2  4630
4634  4633  O    -12.558857   -6.761440    1.699054     1  4634  4635
4635  4634  H    -13.220173   -6.095442    1.511061     2  4633
4636  4635  H    -12.424081   -6.705498    2.645065     2  4633
4637  4636  O    -23.982204   -0.751083   28.036425     1  4637  4638
4638  4637  H    -24.210225   -1.424268   28.677564     2  4636
4639  4638  H    -24.657509   -0.823498   27.361925     2  4636
4640  4639  O    -28.883292    1.163031    8.437464     1  4640  4641
4641  4640  H    -29.098031    0.486558    7.795200     2  4639
4642  4641  H    -29.172518    1.980086    8.031258     2  4639
4643  4642  O     -7.726016   -9.576629   27.305304     1  4643  4644
4644  4643  H     -7.858752  -10.514164   27.165159     2  4642
4645  4644  H     -8.519389   -9.286576   27.755480     2  4642
4646  4645  O    -13.899445   -4.414962    1.384616     1  4646  4647
4647  4646  H    -13.135669   -3.841063    1.325289     2  4645
4648  4647  H    -14.532385   -4.035929    0.774737     2  4645
4649  4648  O    -23.630580   -4.125208   22.301407     1  4649  4650
4650  4649  H    -24.585730   -4.180105   22.331502     2  4648
4651  4650  H    -23.331116   -4.977284   22.618454     2  4648
4652  4651  O    -25.083168   -8.931348   -1.789780     1  4652  4653
4653  4652  H    -25.644598   -8.501323   -2.434844     2  4651
4654  4653  H    -24.789828   -8.222966   -1.216738     2  4651
4655  4654  O    -19.465411  -20.323601    4.034553     1  4655  4656
4656  4655  H    -19.320258  -21.104470    3.500317     2  4654
4657  4656  H    -19.004421  -20.504197    4.853763     2  4654
4658  4657  O    -18.823684  -12.809529   -4.354963     1  4658  4659
4659  4658  H    -19.000596  -11.871076   -4.420077     2  4657
4660  4659  H    -18.672538  -12.961084   -3.422001     2  4657
4661  4660  O    -18.326341  -12.763936   -1.843057     1  4661  4662
4662  4661  H    -18.831226  -12.060808   -1.434482     2  4660
4663  4662  H    -17.989729  -13.276160   -1.107836     2  4660
4664  4663  O      3.967332  -16.848055   32.563541     1  4664  4665
4665  4664  H      3.872014  -15.966836   32.202157     2  4663
4666  4665  H      4.817644  -16.836565   33.002938     2  4663
4667  4666  O    -13.214967  -11.790840   13.826044     1  4667  4668
4668  4667  H    -13.222801  -11.770229   14.782990     2  4666
4669  4668  H    -12.908820  -12.671025   13.607457     2  4666
4670  4669  O    -16.826258   -7.485957   -2.205202     1  4670  4671
4671  4670  H    -17.202162   -6.625650   -2.391750     2  4669
4672  4671  H    -15.988562   -7.295416   -1.783075     2  4669
4673  4672  O     -6.945792  -10.584631    8.842007     1  4673  4674
4674  4673  H     -7.226745  -10.232238    7.997545     2  4672
4675  4674  H     -7.285804  -11.479329    8.853799     2  4672
4676  4675  O    -17.344800  -13.459174    3.253109     1  4676  4677
4677  4676  H    -16.748350  -12.778658    2.941057     2  4675
4678  4677  H    -16.773862  -14.109743    3.661790     2  4675
4679  4678  O     30.574787   12.746457   -3.009031     1  4679  4680
4680  4679  H     29.622198   12.807556   -2.937806     2  4678
4681  4680  H     30.901015   13.116860   -2.188904     2  4678
4682  4681  O     -9.176917   -5.083816    0.573988     1  4682  4683
4683  4682  H     -9.329106   -5.806977    1.182354     2  4681
4684  4683  H     -8.529008   -4.532945    1.013291     2  4681
4685  4684  O    -22.079025    0.849781   22.194732     1  4685  4686
4686  4685  H    -21.731505    0.304021   21.489319     2  4684
4687  4686  H    -21.555763    1.650486   22.158677     2  4684
4688  4687  O    -18.000899  -16.713167   16.483318     1  4688  4689
4689  4688  H    -18.620644  -16.331634   17.105074     2  4687
4690  4689  H    -18.549765  -17.063270   15.781601     2  4687
4691  4690  O     -3.925658  -18.908343   28.354953     1  4691  4692
4692  4691  H     -3.822777  -17.992590   28.613878     2  4690
4693  4692  H     -4.801242  -18.952173   27.970683     2  4690
4694  4693  O     22.479787   25.298285   -4.630794     1  4694  4695
4695  4694  H     22.823290   25.289676   -3.737395     2  4693
4696  4695  H     22.553438   24.390398   -4.924987     2  4693
4697  4696  O    -12.581899   -4.780724   27.023931     1  4697  4698
4698  4697  H    -13.059681   -4.026829   26.678101     2  4696
4699  4698  H    -11.702593   -4.446742   27.201437     2  4696
4700  4699  O    -31.085162    4.215042   15.378613     1  4700  4701
4701  4700  H    -31.979085    4.066256   15.070399     2  4699
4702  4701  H    -30.930987    3.516096   16.014173     2  4699
4703  4702  O    -24.449905   -7.989223   15.693623     1  4703  4704
4704  4703  H    -24.185427   -7.224887   15.181691     2  4702
4705  4704  H    -25.330193   -7.777231   16.004078     2  4702
4706  4705  O     10.878714   27.893404  -12.419194     1  4706  4707
4707  4706  H     11.403385   27.345913  -11.835066     2  4705
4708  4707  H     11.017473   27.518177  -13.288783     2  4705
4709  4708  O    -15.156019   -2.061002    0.265799     1  4709  4710
4710  4709  H    -15.070659   -1.649091   -0.594011     2  4708
4711  4710  H    -14.896715   -1.379046    0.885419     2  4708
4712  4711  O     -1.512494  -13.279518   31.913862     1  4712  4713
4713  4712  H     -2.369727  -13.604175   32.189508     2  4711
4714  4713  H     -1.600651  -13.139666   30.971046     2  4711
4715  4714  O    -13.270474  -31.558133    9.736838     1  4715  4716
4716  4715  H    -12.445615  -31.799993   10.157959     2  4714
4717  4716  H    -13.058660  -30.777709    9.224681     2  4714
4718  4717  O    -29.787283  -14.958739    2.491668     1  4718  4719
4719  4718  H    -29.571237  -15.593040    3.175203     2  4717
4720  4719  H    -30.739381  -15.011060    2.407978     2  4717
4721  4720  O     19.697537   31.144587   -2.553722     1  4721  4722
4722  4721  H     19.631384   31.294948   -3.496721     2  4720
4723  4722  H     19.945854   30.223567   -2.474397     2  4720
4724  4723  O     -5.107118  -19.570141   24.170154     1  4724  4725
4725  4724  H     -5.087495  -19.365487   25.105014     2  4723
4726  4725  H     -4.185759  -19.609030   23.913605     2  4723
4727  4726  O     11.449473    7.965577   33.649815     1  4727  4728
4728  4727  H     12.023137    8.731813   33.654646     2  4726
4729  4728  H     10.974192    8.016383   34.479128     2  4726
4730  4729  O    -31.738365   11.521028   -3.428623     1  4730  4731
4731  4730  H    -30.817721   11.336848   -3.242283     2  4729
4732  4731  H    -32.047339   12.001127   -2.660331     2  4729
4733  4732  O     -4.457170  -10.301843   32.923504     1  4733  4734
4734  4733  H     -4.757390  -10.747819   32.131541     2  4732
4735  4734  H     -3.835636   -9.645610   32.608408     2  4732
4736  4735  O     -9.729204  -13.054430   -3.305105     1  4736  4737
4737  4736  H     -9.583121  -12.130640   -3.508830     2  4735
4738  4737  H     -9.811286  -13.079876   -2.351771     2  4735
4739  4738  O     -4.930164   -5.390839   25.410742     1  4739  4740
4740  4739  H     -5.500036   -6.123347   25.645069     2  4738
4741  4740  H     -4.330827   -5.306290   26.152280     2  4738
4742  4741  O     -6.736689  -18.821321   27.653287     1  4742  4743
4743  4742  H     -7.294758  -19.022002   26.901943     2  4741
4744  4743  H     -7.053067  -17.974442   27.967823     2  4741
4745  4744  O     10.510645   32.372062   -7.386712     1  4745  4746
4746  4745  H     11.268432   32.088229   -7.898012     2  4744
4747  4746  H      9.886795   31.649912   -7.461148     2  4744
4748  4747  O     -3.991684   -4.988268  -35.297662     1  4748  4749
4749  4748  H     -4.158746   -5.895086  -35.554571     2  4747
4750  4749  H     -4.848793   -4.564452  -35.342107     2  4747
4751  4750  O     27.928110   15.641092  -10.255526     1  4751  4752
4752  4751  H     28.671986   15.115425  -10.549729     2  4750
4753  4752  H     27.764997   16.250280  -10.975607     2  4750
4754  4753  O     -4.003997   -0.544986   26.485448     1  4754  4755
4755  4754  H     -3.700193   -1.325055   26.021309     2  4753
4756  4755  H     -4.560315   -0.090690   25.852710     2  4753
4757  4756  O    -10.705969   -4.207460   23.263783     1  4757  4758
4758  4757  H    -11.365335   -3.611273   23.618789     2  4756
4759  4758  H    -10.798236   -5.005086   23.784851     2  4756
4760  4759  O    -15.129789   -7.354005   -5.068242     1  4760  4761
4761  4760  H    -14.271484   -7.010994   -5.317014     2  4759
4762  4761  H    -15.405785   -6.802282   -4.336354     2  4759
4763  4762  O    -33.233818   -1.338147    0.088428     1  4763  4764
4764  4763  H    -32.916583   -1.528590   -0.794366     2  4762
4765  4764  H    -33.994310   -1.908911    0.198486     2  4762
4766  4765  O     -6.616865   -8.551598   16.744046     1  4766  4767
4767  4766  H     -5.729379   -8.816380   16.985896     2  4765
4768  4767  H     -6.538765   -8.248494   15.839468     2  4765
4769  4768  O    -17.306703    2.202520   26.173405     1  4769  4770
4770  4769  H    -18.020811    1.844633   25.645959     2  4768
4771  4770  H    -17.255911    1.622890   26.933458     2  4768
4772  4771  O     -0.547578   -8.646578    0.084197     1  4772  4773
4773  4772  H     -1.108262   -8.991944    0.778882     2  4771
4774  4773  H     -0.353680   -9.404793   -0.466934     2  4771
4775  4774  O    -18.842623    0.051723   24.972455     1  4775  4776
4776  4775  H    -19.461851   -0.205258   24.289264     2  4774
4777  4776  H    -19.274797   -0.190426   25.791491     2  4774
4778  4777  O      6.616719  -28.457446   15.268777     1  4778  4779
4779  4778  H      6.692828  -29.400134   15.416352     2  4777
4780  4779  H      5.794896  -28.355257   14.788780     2  4777
4781  4780  O    -26.713591   -3.185043   23.812702     1  4781  4782
4782  4781  H    -26.982363   -4.094074   23.945575     2  4780
4783  4782  H    -26.374287   -2.908245   24.663870     2  4780
4784  4783  O     31.699482    9.897055   -4.335620     1  4784  4785
4785  4784  H     32.232131    9.195110   -3.961733     2  4783
4786  4785  H     30.990692   10.022543   -3.704667     2  4783
4787  4786  O    -19.506363   -7.772252    1.643897     1  4787  4788
4788  4787  H    -18.897656   -8.258448    2.200064     2  4786
4789  4788  H    -18.968471   -7.094399    1.234730     2  4786
4790  4789  O    -25.124770  -11.780327   -1.644063     1  4790  4791
4791  4790  H    -24.269219  -11.853422   -2.067052     2  4789
4792  4791  H    -25.236488  -10.842396   -1.489027     2  4789
4793  4792  O    -11.883709   -3.962624  -31.734627     1  4793  4794
4794  4793  H    -11.791492   -4.915148  -31.755246     2  4792
4795  4794  H    -11.970065   -3.709921  -32.653820     2  4792
4796  4795  O     -0.133153   16.539921   -3.802460     1  4796  4797
4797  4796  H      0.752531   16.177080   -3.814387     2  4795
4798  4797  H     -0.271754   16.804814   -2.893146     2  4795
4799  4798  O    -23.218491   -2.727208  -23.744160     1  4799  4800
4800  4799  H    -22.341648   -2.345927  -23.699403     2  4798
4801  4800  H    -23.429516   -2.950801  -22.837680     2  4798
4802  4801  O    -25.346967    6.446451  -13.870621     1  4802  4803
4803  4802  H    -24.615777    5.954999  -14.244876     2  4801
4804  4803  H    -24.983277    7.311625  -13.682377     2  4801
4805  4804  O    -18.204414   12.890291    2.986489     1  4805  4806
4806  4805  H    -18.393508   13.621675    2.398652     2  4804
4807  4806  H    -19.040363   12.703442    3.413700     2  4804
4808  4807  O     -6.066757   19.292010   -6.254315     1  4808  4809
4809  4808  H     -5.946658   20.031882   -5.659002     2  4807
4810  4809  H     -5.815566   18.525768   -5.738556     2  4807
4811  4810  O    -16.801746   13.611680  -17.067167     1  4811  4812
4812  4811  H    -17.389459   12.860107  -17.144387     2  4810
4813  4812  H    -16.516828   13.786678  -17.964066     2  4810
4814  4813  O     -6.721720    6.525653  -11.515202     1  4814  4815
4815  4814  H     -5.797699    6.336672  -11.678612     2  4813
4816  4815  H     -7.071449    5.713773  -11.148090     2  4813
4817  4816  O     -5.965762    9.460842    0.478666     1  4817  4818
4818  4817  H     -6.729434    8.923531    0.268110     2  4816
4819  4818  H     -5.619115    9.079578    1.285329     2  4816
4820  4819  O     -5.605892   10.597686    5.148755     1  4820  4821
4821  4820  H     -5.231228    9.894149    4.618761     2  4819
4822  4821  H     -5.226460   11.398643    4.787187     2  4819
4823  4822  O     -7.581171   23.058154   -5.211274     1  4823  4824
4824  4823  H     -8.441124   22.646841   -5.298083     2  4822
4825  4824  H     -7.482146   23.211292   -4.271607     2  4822
4826  4825  O    -17.416907    8.281332   -4.498398     1  4826  4827
4827  4826  H    -16.538368    7.950131   -4.684695     2  4825
4828  4827  H    -17.353502    8.646744   -3.615966     2  4825
4829  4828  O      4.773939   11.503362  -26.456151     1  4829  4830
4830  4829  H      5.012795   11.266536  -27.352306     2  4828
4831  4830  H      5.485329   12.071374  -26.160315     2  4828
4832  4831  O      5.235424   14.769278  -10.930941     1  4832  4833
4833  4832  H      5.298279   13.920204  -11.368382     2  4831
4834  4833  H      4.948759   15.372070  -11.617014     2  4831
4835  4834  O     -9.943261   -0.041803  -24.382671     1  4835  4836
4836  4835  H     -9.425096   -0.344563  -23.636968     2  4834
4837  4836  H     -9.401562    0.631949  -24.793587     2  4834
4838  4837  O     -7.140859    4.663727   -9.661810     1  4838  4839
4839  4838  H     -6.507925    4.295552   -9.045308     2  4837
4840  4839  H     -7.977915    4.275773   -9.406741     2  4837
4841  4840  O    -16.557914    6.126937  -24.412322     1  4841  4842
4842  4841  H    -16.067062    6.241930  -23.598644     2  4840
4843  4842  H    -17.476072    6.134614  -24.141845     2  4840
4844  4843  O     -7.010061   14.026995  -24.137402     1  4844  4845
4845  4844  H     -6.515408   14.671592  -23.631392     2  4843
4846  4845  H     -7.026335   14.381093  -25.026548     2  4843
4847  4846  O    -24.514664    9.090587  -14.157631     1  4847  4848
4848  4847  H    -23.931444    9.313517  -13.432105     2  4846
4849  4848  H    -24.804270    9.935782  -14.501150     2  4846
4850  4849  O    -20.996795    0.237290  -26.983340     1  4850  4851
4851  4850  H    -20.752735   -0.685713  -26.914549     2  4849
4852  4851  H    -20.676808    0.631265  -26.171784     2  4849
4853  4852  O     -6.971897   27.591519  -16.791187     1  4853  4854
4854  4853  H     -6.342624   26.931469  -16.500358     2  4852
4855  4854  H     -6.556393   28.427994  -16.581670     2  4852
4856  4855  O    -31.558807    3.062357   -8.998855     1  4856  4857
4857  4856  H    -31.448866    2.656736   -8.138845     2  4855
4858  4857  H    -31.100405    2.476250   -9.600999     2  4855
4859  4858  O    -21.004007    0.557954   -9.867033     1  4859  4860
4860  4859  H    -21.350591    1.444848   -9.964658     2  4858
4861  4860  H    -20.128436    0.681449   -9.500486     2  4858
4862  4861  O    -16.037959   17.721592  -12.770947     1  4862  4863
4863  4862  H    -16.601039   17.054289  -13.163219     2  4861
4864  4863  H    -16.613734   18.201934  -12.175979     2  4861
4865  4864  O    -16.499271    7.977894  -13.401756     1  4865  4866
4866  4865  H    -16.480996    7.056961  -13.141411     2  4864
4867  4866  H    -15.727505    8.360614  -12.984460     2  4864
4868  4867  O    -24.817104    5.785885   -1.255262     1  4868  4869
4869  4868  H    -24.648435    6.366204   -0.512960     2  4867
4870  4869  H    -24.028595    5.247460   -1.322964     2  4867
4871  4870  O     -0.060111   24.977784  -16.112202     1  4871  4872
4872  4871  H      0.030453   25.893320  -15.847964     2  4870
4873  4872  H      0.054456   24.989797  -17.062445     2  4870
4874  4873  O    -12.511129   27.910483  -12.784964     1  4874  4875
4875  4874  H    -12.020964   27.107376  -12.960999     2  4873
4876  4875  H    -12.771696   28.227071  -13.649897     2  4873
4877  4876  O    -20.268836    6.207635  -10.930413     1  4877  4878
4878  4877  H    -21.175895    6.512710  -10.950542     2  4876
4879  4878  H    -19.749932    7.004631  -10.821933     2  4876
4880  4879  O    -10.393214   -0.672494  -14.840874     1  4880  4881
4881  4880  H    -10.351326    0.243541  -14.566363     2  4879
4882  4881  H    -11.329436   -0.861585  -14.903843     2  4879
4883  4882  O    -31.605056    8.338495   -9.283740     1  4883  4884
4884  4883  H    -31.084601    7.832544   -8.659742     2  4882
4885  4884  H    -31.500189    9.247384   -9.002395     2  4882
4886  4885  O    -26.542791   14.923847    3.549760     1  4886  4887
4887  4886  H    -25.648057   15.040049    3.869415     2  4885
4888  4887  H    -26.542256   14.056465    3.144939     2  4885
4889  4888  O    -23.820206   -2.107817  -21.059382     1  4889  4890
4890  4889  H    -23.451823   -1.283690  -20.741043     2  4888
4891  4890  H    -23.630472   -2.739369  -20.365570     2  4888
4892  4891  O    -27.120895    4.736590    8.793600     1  4892  4893
4893  4892  H    -27.776462    4.403618    9.406456     2  4891
4894  4893  H    -26.333400    4.853972    9.324923     2  4891
4895  4894  O    -23.160202    8.280489   -9.844089     1  4895  4896
4896  4895  H    -23.810954    8.509469   -9.180521     2  4894
4897  4896  H    -23.341504    8.873983  -10.572872     2  4894
4898  4897  O     -1.743636   11.268145  -24.632871     1  4898  4899
4899  4898  H     -0.857693   10.979845  -24.852462     2  4897
4900  4899  H     -2.267257   10.466997  -24.647494     2  4897
4901  4900  O     32.331021  -11.942984    2.943066     1  4901  4902
4902  4901  H     31.838722  -11.155694    2.710588     2  4900
4903  4902  H     32.172275  -12.547988    2.218496     2  4900
4904  4903  O    -26.147877    5.014334   -8.822023     1  4904  4905
4905  4904  H    -26.310465    5.186033   -9.749556     2  4903
4906  4905  H    -26.656495    5.681854   -8.361636     2  4903
4907  4906  O    -18.199973   18.678594   -5.424558     1  4907  4908
4908  4907  H    -18.539928   19.572998   -5.398026     2  4906
4909  4908  H    -17.558555   18.644502   -4.714873     2  4906
4910  4909  O    -12.562047   -0.826166  -28.401820     1  4910  4911
4911  4910  H    -12.398630   -0.335160  -27.596563     2  4909
4912  4911  H    -13.515552   -0.841046  -28.484515     2  4909
4913  4912  O     -9.307651    7.069209  -16.219147     1  4913  4914
4914  4913  H     -9.796051    6.284119  -16.466799     2  4912
4915  4914  H     -8.801545    6.804644  -15.450971     2  4912
4916  4915  O    -31.069167    0.225456   -4.480054     1  4916  4917
4917  4916  H    -31.379055    0.258123   -3.574994     2  4915
4918  4917  H    -31.856370    0.055013   -4.997250     2  4915
4919  4918  O    -22.999854    3.739676    4.429573     1  4919  4920
4920  4919  H    -22.884994    3.035514    3.791456     2  4918
4921  4920  H    -23.197811    3.289450    5.250756     2  4918
4922  4921  O    -27.500050   16.961239   -3.245698     1  4922  4923
4923  4922  H    -27.595265   16.989408   -2.293662     2  4921
4924  4923  H    -28.389614   16.825301   -3.571932     2  4921
4925  4924  O     35.060241    1.201009  -13.596940     1  4925  4926
4926  4925  H     35.188531    1.605073  -12.738740     2  4924
4927  4926  H     34.843313    0.289141  -13.402851     2  4924
4928  4927  O    -28.478228   10.260829   -4.621561     1  4928  4929
4929  4928  H    -28.322390   11.204045   -4.669410     2  4927
4930  4929  H    -28.480656   10.065218   -3.684565     2  4927
4931  4930  O    -20.354138   10.993068  -10.385887     1  4931  4932
4932  4931  H    -19.519292   11.461080  -10.400994     2  4930
4933  4932  H    -21.011694   11.678934  -10.269966     2  4930
4934  4933  O     -9.632103   31.297177    1.426373     1  4934  4935
4935  4934  H     -8.914071   30.907860    1.925465     2  4933
4936  4935  H     -9.662966   32.207508    1.720610     2  4933
4937  4936  O      8.179727   31.842204    9.174025     1  4937  4938
4938  4937  H      9.005254   32.097364    8.762165     2  4936
4939  4938  H      7.887971   32.629042    9.634455     2  4936
4940  4939  O     -3.299459   16.151969   -0.674606     1  4940  4941
4941  4940  H     -4.219196   16.043002   -0.432859     2  4939
4942  4941  H     -3.095596   15.377209   -1.198456     2  4939
4943  4942  O    -21.832929    7.311419   -7.229929     1  4943  4944
4944  4943  H    -22.031381    7.649478   -8.103178     2  4942
4945  4944  H    -22.415468    6.559074   -7.125737     2  4942
4946  4945  O    -14.302203   17.197918  -15.177024     1  4946  4947
4947  4946  H    -15.176441   17.145664  -14.790750     2  4945
4948  4947  H    -14.361842   16.676135  -15.977286     2  4945
4949  4948  O      2.100045   13.513469  -13.163701     1  4949  4950
4950  4949  H      1.709077   14.030030  -12.459044     2  4948
4951  4950  H      1.976984   14.046818  -13.948957     2  4948
4952  4951  O     -1.086362   17.828024   -8.270467     1  4952  4953
4953  4952  H     -0.381128   17.773996   -8.915414     2  4951
4954  4953  H     -1.099775   18.747870   -8.006013     2  4951
4955  4954  O    -25.421268   21.704699   -3.313686     1  4955  4956
4956  4955  H    -26.115911   21.099873   -3.574240     2  4954
4957  4956  H    -24.970881   21.919164   -4.130624     2  4954
4958  4957  O    -29.218535   13.298992   -7.687543     1  4958  4959
4959  4958  H    -29.740127   12.781300   -8.300868     2  4957
4960  4959  H    -28.440841   12.765435   -7.524018     2  4957
4961  4960  O     -4.437345    0.328426  -20.857732     1  4961  4962
4962  4961  H     -4.709379    0.390244  -19.942086     2  4960
4963  4962  H     -5.145947   -0.151216  -21.286750     2  4960
4964  4963  O     -6.489007   26.169194   -5.737262     1  4964  4965
4965  4964  H     -7.360546   25.776682   -5.686416     2  4963
4966  4965  H     -5.965736   25.529931   -6.220751     2  4963
4967  4966  O    -15.181334    1.944922   -1.026257     1  4967  4968
4968  4967  H    -15.107648    1.047563   -0.701375     2  4966
4969  4968  H    -14.424562    2.054607   -1.602013     2  4966
4970  4969  O    -12.027598    4.795552  -22.631035     1  4970  4971
4971  4970  H    -11.830432    3.858957  -22.643166     2  4969
4972  4971  H    -12.327870    4.989110  -23.519068     2  4969
4973  4972  O    -13.266724   15.231979    0.504144     1  4973  4974
4974  4973  H    -13.502803   14.395703    0.905567     2  4972
4975  4974  H    -12.353298   15.369314    0.755188     2  4972
4976  4975  O    -25.860515    7.134563   -5.485096     1  4976  4977
4977  4976  H    -26.196514    6.293520   -5.175286     2  4975
4978  4977  H    -25.361502    7.480852   -4.745298     2  4975
4979  4978  O    -16.233888    7.751301  -18.548466     1  4979  4980
4980  4979  H    -16.412536    7.065155  -19.191521     2  4978
4981  4980  H    -16.762599    8.494924  -18.837812     2  4978
4982  4981  O     -4.753929   15.331653  -23.361824     1  4982  4983
4983  4982  H     -4.078323   14.731269  -23.676987     2  4981
4984  4983  H     -4.293530   15.916333  -22.759815     2  4981
4985  4984  O     -9.746095   16.349983  -24.863232     1  4985  4986
4986  4985  H     -9.651006   15.953417  -25.729214     2  4984
4987  4986  H    -10.685754   16.313611  -24.684489     2  4984
4988  4987  O    -22.261492   16.081616   -5.263627     1  4988  4989
4989  4988  H    -22.011734   15.206298   -5.559720     2  4987
4990  4989  H    -22.360654   15.995044   -4.315522     2  4987
4991  4990  O     -9.035837    2.167831  -20.577643     1  4991  4992
4992  4991  H     -9.811998    1.844828  -21.035328     2  4990
4993  4992  H     -8.796476    1.458558  -19.981095     2  4990
4994  4993  O    -11.025940   16.156812  -10.847074     1  4994  4995
4995  4994  H    -11.514098   16.930124  -11.129778     2  4993
4996  4995  H    -11.666467   15.445976  -10.872907     2  4993
4997  4996  O    -10.839683   36.184642   -1.668757     1  4997  4998
4998  4997  H    -10.465768   35.449733   -2.154893     2  4996
4999  4998  H    -10.847318   36.907990   -2.295606     2  4996
5000  4999  O    -17.795845    9.591413  -19.727134     1  5000  5001
5001  5000  H    -18.553138    9.141294  -20.101476     2  4999
5002  5001  H    -17.296556    9.892935  -20.486098     2  4999
5003  5002  O    -22.483662   11.378975  -14.475838     1  5003  5004
5004  5003  H    -23.244175   11.530438  -15.037008     2  5002
5005  5004  H    -21.740334   11.361252  -15.078649     2  5002
5006  5005  O      9.241172  -13.403246   18.674303     1  5006  5007
5007  5006  H      9.266754  -13.743157   17.779855     2  5005
5008  5007  H      8.555659  -12.735393   18.657720     2  5005
5009  5008  O    -16.968602   17.827710    1.042015     1  5009  5010
5010  5009  H    -16.709812   17.211453    0.356824     2  5008
5011  5010  H    -17.481377   18.493949    0.584393     2  5008
5012  5011  O    -22.276886    9.884528  -12.353527     1  5012  5013
5013  5012  H    -22.295713   10.634542  -12.947966     2  5011
5014  5013  H    -21.490220   10.017217  -11.824584     2  5011
5015  5014  O    -16.777600   13.430590  -22.383743     1  5015  5016
5016  5015  H    -16.260334   14.136998  -22.770595     2  5014
5017  5016  H    -17.072859   12.911818  -23.132028     2  5014
5018  5017  O    -20.073321   13.964123  -12.098159     1  5018  5019
5019  5018  H    -20.452696   13.680075  -11.266521     2  5017
5020  5019  H    -19.779488   13.154979  -12.516705     2  5017
5021  5020  O      3.363963   -1.197625  -33.160451     1  5021  5022
5022  5021  H      3.582696   -1.523236  -32.287316     2  5020
5023  5022  H      3.539515   -0.257665  -33.116991     2  5020
5024  5023  O     17.962900  -26.994167    3.463616     1  5024  5025
5025  5024  H     17.900475  -26.786767    4.395990     2  5023
5026  5025  H     18.764746  -27.511115    3.385915     2  5023
5027  5026  O    -16.297565    5.347008  -13.154087     1  5027  5028
5028  5027  H    -15.343235    5.399867  -13.205956     2  5026
5029  5028  H    -16.558586    4.915415  -13.967615     2  5026
5030  5029  O     -2.467246   35.457260   -7.222802     1  5030  5031
5031  5030  H     -2.794726   36.043927   -6.541032     2  5029
5032  5031  H     -1.535181   35.359598   -7.027996     2  5029
5033  5032  O     19.672320  -24.968719    8.430743     1  5033  5034
5034  5033  H     20.166128  -24.915410    9.248999     2  5032
5035  5034  H     19.547716  -25.906720    8.286312     2  5032
5036  5035  O    -16.242653   13.716105  -19.755488     1  5036  5037
5037  5036  H    -16.871540   14.042737  -20.398951     2  5035
5038  5037  H    -16.036929   12.828856  -20.049934     2  5035
5039  5038  O    -22.381240    2.057346  -24.994076     1  5039  5040
5040  5039  H    -21.930586    1.707170  -24.225624     2  5038
5041  5040  H    -22.779083    1.291746  -25.408573     2  5038
5042  5041  O     -2.778911   20.530364  -28.940454     1  5042  5043
5043  5042  H     -2.702335   19.589643  -29.099867     2  5041
5044  5043  H     -3.560106   20.618426  -28.394367     2  5041
5045  5044  O    -17.681682   21.019871    1.365838     1  5045  5046
5046  5045  H    -17.652628   21.470597    0.521898     2  5044
5047  5046  H    -18.326507   20.323083    1.243697     2  5044
5048  5047  O     -6.541544   33.761883   -5.980314     1  5048  5049
5049  5048  H     -6.410788   34.606480   -5.549279     2  5047
5050  5049  H     -5.786068   33.237463   -5.714851     2  5047
5051  5050  O    -11.262937    7.332160  -21.649465     1  5051  5052
5052  5051  H    -11.464315    6.396997  -21.683365     2  5050
5053  5052  H    -10.596789    7.458845  -22.325060     2  5050
5054  5053  O     -6.954896    6.515855   -6.560090     1  5054  5055
5055  5054  H     -6.930468    5.681674   -6.091288     2  5053
5056  5055  H     -6.364157    6.391107   -7.302853     2  5053
5057  5056  O     -8.382870  -36.188268   -4.293534     1  5057  5058
5058  5057  H     -8.869716  -37.012401   -4.297819     2  5056
5059  5058  H     -7.643685  -36.349245   -3.707084     2  5056
5060  5059  O    -20.227728   13.923335  -19.041953     1  5060  5061
5061  5060  H    -19.733001   14.741783  -19.001716     2  5059
5062  5061  H    -19.895256   13.480065  -19.822469     2  5059
5063  5062  O     17.411266   -8.371410   28.243873     1  5063  5064
5064  5063  H     18.162900   -8.091876   28.766499     2  5062
5065  5064  H     16.735553   -8.581462   28.888482     2  5062
5066  5065  O    -10.031621   22.064046  -18.817273     1  5066  5067
5067  5066  H    -10.546740   21.606269  -19.481596     2  5065
5068  5067  H    -10.472816   21.864189  -17.991660     2  5065
5069  5068  O    -19.873912   19.849578   -2.872015     1  5069  5070
5070  5069  H    -19.663921   20.338310   -3.667802     2  5068
5071  5070  H    -20.799787   20.034243   -2.714257     2  5068
5072  5071  O    -10.375656    5.064620   -3.615129     1  5072  5073
5073  5072  H    -10.883231    4.832382   -4.392730     2  5071
5074  5073  H     -9.703911    5.665440   -3.937631     2  5071
5075  5074  O     29.330484  -14.015486    0.400737     1  5075  5076
5076  5075  H     29.160111  -14.104456    1.338441     2  5074
5077  5076  H     28.593287  -13.501924    0.070545     2  5074
5078  5077  O    -18.680530   21.573693    3.824763     1  5078  5079
5079  5078  H    -18.800317   20.652419    4.055276     2  5077
5080  5079  H    -18.422859   21.558904    2.903015     2  5077
5081  5080  O     -9.713028    9.336510  -10.414251     1  5081  5082
5082  5081  H     -9.588861    8.439008  -10.105538     2  5080
5083  5082  H     -9.317915    9.881265   -9.733546     2  5080
5084  5083  O     -3.517503   -1.180587   -4.623165     1  5084  5085
5085  5084  H     -3.635520   -1.115028   -3.675534     2  5083
5086  5085  H     -2.740907   -0.651532   -4.805460     2  5083
5087  5086  O    -25.940737   16.089625   -5.959431     1  5087  5088
5088  5087  H    -26.315647   16.043909   -5.079894     2  5086
5089  5088  H    -25.066272   16.456337   -5.828800     2  5086
5090  5089  O      1.913649   15.217097  -15.791809     1  5090  5091
5091  5090  H      1.758352   16.160847  -15.753729     2  5089
5092  5091  H      1.502443   14.939048  -16.610240     2  5089
5093  5092  O     -8.913921    7.891207  -23.159941     1  5093  5094
5094  5093  H     -8.500608    7.765137  -24.014054     2  5092
5095  5094  H     -8.398793    8.582322  -22.743725     2  5092
5096  5095  O     -0.991791    7.170992   -9.210435     1  5096  5097
5097  5096  H     -1.871569    7.374010   -9.528248     2  5095
5098  5097  H     -1.107226    6.392763   -8.665214     2  5095
5099  5098  O    -10.462703    8.877311  -13.978838     1  5099  5100
5100  5099  H    -10.470206    9.123376  -14.903839     2  5098
5101  5100  H     -9.806637    8.182749  -13.920583     2  5098
5102  5101  O    -21.851373   -1.510205  -11.733971     1  5102  5103
5103  5102  H    -21.400702   -0.831457  -11.231548     2  5101
5104  5103  H    -21.959059   -2.233947  -11.116855     2  5101
5105  5104  O      2.753139   20.597062    3.114666     1  5105  5106
5106  5105  H      2.390717   19.968495    2.490339     2  5104
5107  5106  H      2.768055   21.427137    2.638238     2  5104
5108  5107  O    -22.400918    3.867237   -1.304942     1  5108  5109
5109  5108  H    -21.737035    3.177906   -1.322678     2  5107
5110  5109  H    -22.289957    4.285377   -0.451081     2  5107
5111  5110  O    -21.192894    0.919763  -22.342800     1  5111  5112
5112  5111  H    -20.305587    0.789521  -22.008200     2  5110
5113  5112  H    -21.759868    0.758208  -21.588697     2  5110
5114  5113  O     -3.864358   16.209512  -31.117863     1  5114  5115
5115  5114  H     -3.504788   16.159414  -30.232182     2  5113
5116  5115  H     -4.498254   16.925700  -31.079368     2  5113
5117  5116  O    -25.257170    0.698716   -7.327458     1  5117  5118
5118  5117  H    -25.099800    0.996214   -6.431377     2  5116
5119  5118  H    -24.382608    0.575240   -7.696411     2  5116
5120  5119  O    -23.731252    3.722648  -23.240878     1  5120  5121
5121  5120  H    -23.391884    4.599974  -23.417970     2  5119
5122  5121  H    -23.277826    3.158903  -23.867637     2  5119
5123  5122  O    -13.692557    7.652893   -4.791157     1  5123  5124
5124  5123  H    -14.485218    7.334849   -5.223323     2  5122
5125  5124  H    -13.070234    7.793711   -5.504682     2  5122
5126  5125  O    -16.688902   22.429883   -2.341664     1  5126  5127
5127  5126  H    -16.287867   22.542133   -1.479805     2  5125
5128  5127  H    -17.618843   22.605698   -2.198383     2  5125
5129  5128  O     -3.611811   16.726875   -8.172510     1  5129  5130
5130  5129  H     -2.855867   17.269428   -8.397046     2  5128
5131  5130  H     -3.629285   16.723893   -7.215474     2  5128
5132  5131  O    -21.118088   22.569275   -5.808964     1  5132  5133
5133  5132  H    -21.798809   22.953249   -5.256321     2  5131
5134  5133  H    -21.596831   22.158292   -6.528777     2  5131
5135  5134  O    -19.521562   -2.683910  -29.251437     1  5135  5136
5136  5135  H    -18.715516   -2.971179  -29.680388     2  5134
5137  5136  H    -20.221816   -3.106343  -29.748856     2  5134
5138  5137  O      0.015336   22.348070   -8.996398     1  5138  5139
5139  5138  H      0.666396   23.046641   -9.062363     2  5137
5140  5139  H     -0.808731   22.763216   -9.250955     2  5137
5141  5140  O    -10.189793    2.461958  -25.734614     1  5141  5142
5142  5141  H    -10.036759    2.445856  -26.679365     2  5140
5143  5142  H    -10.392102    3.377033  -25.539831     2  5140
5144  5143  O     12.199014   33.341228    7.774216     1  5144  5145
5145  5144  H     12.909937   32.914564    8.252523     2  5143
5146  5145  H     12.524814   34.223620    7.596818     2  5143
5147  5146  O    -30.152520   15.206665   -2.474108     1  5147  5148
5148  5147  H    -29.720065   15.955718   -2.064066     2  5146
5149  5148  H    -30.160273   14.532512   -1.794631     2  5146
5150  5149  O    -22.527917   10.741457  -17.352636     1  5150  5151
5151  5150  H    -23.358088   10.290651  -17.506979     2  5149
5152  5151  H    -21.874722   10.199786  -17.795536     2  5149
5153  5152  O    -26.153954   14.809542   -8.303141     1  5153  5154
5154  5153  H    -27.049413   14.488272   -8.197454     2  5152
5155  5154  H    -25.988864   15.324287   -7.513196     2  5152
5156  5155  O     -9.339252   12.605758  -23.860992     1  5156  5157
5157  5156  H     -8.554981   13.015598  -24.225931     2  5155
5158  5157  H     -9.902009   12.447280  -24.618898     2  5155
5159  5158  O     30.176882    9.094332    4.053600     1  5159  5160
5160  5159  H     30.086283    9.507751    3.195050     2  5158
5161  5160  H     29.277404    8.973004    4.357658     2  5158
5162  5161  O     -8.990791   14.156842  -10.375453     1  5162  5163
5163  5162  H     -9.321852   13.511386  -10.999966     2  5161
5164  5163  H     -9.672554   14.827772  -10.339641     2  5161
5165  5164  O     -4.344674  -32.833039   -6.972809     1  5165  5166
5166  5165  H     -4.814290  -33.647368   -6.792360     2  5164
5167  5166  H     -3.421612  -33.086076   -6.985482     2  5164
5168  5167  O    -25.925912    5.133700  -11.715688     1  5168  5169
5169  5168  H    -26.166844    4.224307  -11.892287     2  5167
5170  5169  H    -25.660790    5.481417  -12.567178     2  5167
5171  5170  O     -8.872329   17.693320  -18.395856     1  5171  5172
5172  5171  H     -8.114037   18.277340  -18.383813     2  5170
5173  5172  H     -9.291528   17.826743  -17.545738     2  5170
5174  5173  O     30.928179    4.083176   -0.069688     1  5174  5175
5175  5174  H     31.759241    3.837710    0.336900     2  5173
5176  5175  H     30.854771    3.508440   -0.831608     2  5173
5177  5176  O    -18.967917   -0.114853  -28.949053     1  5177  5178
5178  5177  H    -19.101874   -1.043796  -29.137078     2  5176
5179  5178  H    -19.712598    0.128503  -28.399090     2  5176
5180  5179  O    -32.622266    2.460261  -12.516605     1  5180  5181
5181  5180  H    -32.349670    3.095075  -11.854084     2  5179
5182  5181  H    -31.897704    1.836552  -12.563831     2  5179
5183  5182  O     -3.045237   21.243093  -19.296882     1  5183  5184
5184  5183  H     -2.506511   20.906420  -20.012883     2  5182
5185  5184  H     -2.445504   21.777047  -18.775878     2  5182
5186  5185  O    -20.551983    3.256538  -19.013978     1  5186  5187
5187  5186  H    -19.646674    2.945818  -19.023961     2  5185
5188  5187  H    -20.974521    2.742629  -18.325799     2  5185
5189  5188  O    -26.964426    1.142679  -15.851052     1  5189  5190
5190  5189  H    -27.311387    2.011926  -15.650405     2  5188
5191  5190  H    -26.360477    1.287597  -16.579390     2  5188
5192  5191  O    -30.999407    8.037394   -5.546894     1  5192  5193
5193  5192  H    -30.415096    8.776840   -5.379464     2  5191
5194  5193  H    -30.721639    7.700076   -6.398535     2  5191
5195  5194  O    -13.037145    6.519151   -0.447364     1  5195  5196
5196  5195  H    -13.755225    5.964254   -0.751800     2  5194
5197  5196  H    -12.823002    7.069365   -1.200782     2  5194
5198  5197  O      6.009739   35.456055   10.276071     1  5198  5199
5199  5198  H      5.740081   34.604616   10.620407     2  5197
5200  5199  H      6.463592   35.877309   11.005998     2  5197
5201  5200  O    -16.619848   17.158340   -3.601093     1  5201  5202
5202  5201  H    -15.905346   17.791636   -3.669318     2  5200
5203  5202  H    -16.941560   17.255133   -2.704788     2  5200
5204  5203  O      0.792641   15.527204  -11.712614     1  5204  5205
5205  5204  H      0.107249   14.919850  -11.434065     2  5203
5206  5205  H      0.322670   16.229801  -12.161743     2  5203
5207  5206  O     -5.301707    3.296849   -0.996766     1  5207  5208
5208  5207  H     -6.169513    3.624116   -0.760034     2  5206
5209  5208  H     -4.780973    3.399540   -0.200197     2  5206
5210  5209  O    -12.256187   18.530372  -12.038536     1  5210  5211
5211  5210  H    -11.806128   19.233691  -11.570538     2  5209
5212  5211  H    -12.013781   18.658850  -12.955577     2  5209
5213  5212  O    -34.296108    9.778950   -3.518011     1  5213  5214
5214  5213  H    -34.595732    9.763997   -2.609037     2  5212
5215  5214  H    -33.534572   10.358806   -3.510168     2  5212
5216  5215  O    -25.074717    1.591213  -26.913389     1  5216  5217
5217  5216  H    -25.298266    1.999775  -26.077126     2  5215
5218  5217  H    -24.371463    0.977782  -26.700393     2  5215
5219  5218  O     -6.558938   13.338693   -4.960808     1  5219  5220
5220  5219  H     -6.790641   14.232587   -4.708821     2  5218
5221  5220  H     -6.710523   12.819746   -4.170905     2  5218
5222  5221  O    -29.982855   12.787588    3.520183     1  5222  5223
5223  5222  H    -29.159553   12.516218    3.926093     2  5221
5224  5223  H    -30.631315   12.168577    3.855679     2  5221
5225  5224  O    -20.233770   12.719007   -2.189855     1  5225  5226
5226  5225  H    -20.026116   13.551479   -2.614239     2  5224
5227  5226  H    -21.190283   12.682817   -2.187583     2  5224
5228  5227  O    -21.241504   16.108764    3.400052     1  5228  5229
5229  5228  H    -21.392514   15.894376    2.479473     2  5227
5230  5229  H    -21.859558   16.815534    3.586376     2  5227
5231  5230  O     12.275483   -1.690558  -33.057734     1  5231  5232
5232  5231  H     11.701159   -1.130332  -32.535690     2  5230
5233  5232  H     12.709538   -1.090512  -33.664176     2  5230
5234  5233  O     -3.810811    4.349783    1.310375     1  5234  5235
5235  5234  H     -3.521678    3.529870    1.710845     2  5233
5236  5235  H     -4.209942    4.840202    2.028996     2  5233
5237  5236  O    -27.260177    4.905079   -4.724067     1  5237  5238
5238  5237  H    -26.742397    4.105664   -4.819312     2  5236
5239  5238  H    -28.114852    4.682862   -5.093366     2  5236
5240  5239  O     -1.278214   19.970421  -21.097348     1  5240  5241
5241  5240  H     -0.728409   19.213762  -20.893843     2  5239
5242  5241  H     -1.238019   20.046829  -22.050646     2  5239
5243  5242  O    -15.267583   20.206696    2.592597     1  5243  5244
5244  5243  H    -14.839553   19.859592    1.809947     2  5242
5245  5244  H    -16.077698   20.600278    2.268503     2  5242
5246  5245  O    -33.326565    2.210133   -3.900279     1  5246  5247
5247  5246  H    -33.897270    2.394215   -4.646362     2  5245
5248  5247  H    -33.914602    1.867810   -3.227034     2  5245
5249  5248  O    -27.499789    9.988396  -13.042163     1  5249  5250
5250  5249  H    -28.391060    9.685825  -13.216285     2  5248
5251  5250  H    -26.957699    9.205170  -13.136651     2  5248
5252  5251  O      1.091181   30.016954  -21.907760     1  5252  5253
5253  5252  H      1.446490   30.346636  -21.082352     2  5251
5254  5253  H      0.901962   30.803822  -22.418903     2  5251
5255  5254  O    -12.459913   15.318364  -18.743002     1  5255  5256
5256  5255  H    -11.888666   14.552851  -18.680557     2  5254
5257  5256  H    -11.864743   16.048824  -18.911614     2  5254
5258  5257  O     23.449849   -1.256013   29.561464     1  5258  5259
5259  5258  H     23.695142   -1.211118   30.485610     2  5257
5260  5259  H     23.510126   -2.185777   29.342062     2  5257
5261  5260  O     21.142648  -17.590372   13.924755     1  5261  5262
5262  5261  H     20.633552  -18.087723   14.564828     2  5260
5263  5262  H     21.666352  -18.249963   13.469887     2  5260
5264  5263  O     -4.169353    2.721024  -27.834206     1  5264  5265
5265  5264  H     -4.019770    1.820366  -27.546679     2  5263
5266  5265  H     -3.422023    3.210104  -27.489922     2  5263
5267  5266  O     -7.460933   23.888257  -13.093658     1  5267  5268
5268  5267  H     -7.643941   23.409694  -13.902186     2  5266
5269  5268  H     -6.505625   23.930339  -13.050681     2  5266
5270  5269  O     -6.769794    1.269000  -15.915354     1  5270  5271
5271  5270  H     -6.883804    1.055664  -14.989222     2  5269
5272  5271  H     -7.557371    1.761256  -16.146953     2  5269
5273  5272  O    -10.939918   25.830805  -13.913307     1  5273  5274
5274  5273  H    -10.278717   26.432287  -14.255746     2  5272
5275  5274  H    -10.449320   25.227159  -13.355493     2  5272
5276  5275  O    -14.265283   19.358394    0.088175     1  5276  5277
5277  5276  H    -13.425416   18.909976   -0.010700     2  5275
5278  5277  H    -14.916697   18.657804    0.055537     2  5275
5279  5278  O    -33.793857    7.053550  -10.108340     1  5279  5280
5280  5279  H    -34.223047    7.535902   -9.401684     2  5278
5281  5280  H    -32.904509    7.406567  -10.134231     2  5278
5282  5281  O    -13.280308    1.299558  -18.831769     1  5282  5283
5283  5282  H    -14.030419    1.724203  -19.247992     2  5281
5284  5283  H    -13.516181    0.372395  -18.800700     2  5281
5285  5284  O    -17.254929   -0.082591  -26.196537     1  5285  5286
5286  5285  H    -17.943283    0.122375  -25.563774     2  5284
5287  5286  H    -17.545212   -0.894397  -26.612397     2  5284
5288  5287  O     13.886932   -6.906282   33.461933     1  5288  5289
5289  5288  H     13.119825   -6.349950   33.597110     2  5287
5290  5289  H     14.631726   -6.343910   33.674653     2  5287
5291  5290  O      0.856113   17.643440    6.560900     1  5291  5292
5292  5291  H      1.648873   17.114756    6.651773     2  5290
5293  5292  H      1.145968   18.434481    6.106511     2  5290
5294  5293  O    -16.848721   24.221276  -10.051471     1  5294  5295
5295  5294  H    -17.296186   24.084428  -10.886503     2  5293
5296  5295  H    -17.550330   24.220852   -9.400336     2  5293
5297  5296  O     -6.855302   26.807841  -13.490944     1  5297  5298
5298  5297  H     -7.697995   26.939774  -13.925333     2  5296
5299  5298  H     -6.788093   25.859405  -13.380560     2  5296
5300  5299  O     -6.884832   14.742920  -30.932769     1  5300  5301
5301  5300  H     -7.566337   15.344913  -30.633793     2  5299
5302  5301  H     -6.439766   15.214776  -31.636687     2  5299
5303  5302  O    -15.099225   20.318911  -17.491253     1  5303  5304
5304  5303  H    -14.504501   20.620967  -16.804742     2  5302
5305  5304  H    -14.542603   20.217149  -18.263294     2  5302
5306  5305  O     -0.001681   15.228036  -20.616310     1  5306  5307
5307  5306  H      0.135342   16.139868  -20.873250     2  5305
5308  5307  H     -0.533803   15.279801  -19.822334     2  5305
5309  5308  O    -34.359515    6.873340   -0.777226     1  5309  5310
5310  5309  H    -33.646912    6.243863   -0.666825     2  5308
5311  5310  H    -34.616539    6.786315   -1.695156     2  5308
5312  5311  O    -32.297471    2.712201  -15.303401     1  5312  5313
5313  5312  H    -31.416866    2.406929  -15.085284     2  5311
5314  5313  H    -32.836286    2.441575  -14.559983     2  5311
5315  5314  O    -19.925802    1.470123   -1.090737     1  5315  5316
5316  5315  H    -19.107350    1.884053   -1.364654     2  5314
5317  5316  H    -19.972277    1.630738   -0.148254     2  5314
5318  5317  O    -13.790035   13.109982  -16.603235     1  5318  5319
5319  5318  H    -14.696537   12.839638  -16.749517     2  5317
5320  5319  H    -13.630504   13.782875  -17.265049     2  5317
5321  5320  O      1.544031   29.332478  -17.314538     1  5321  5322
5322  5321  H      1.998914   28.994412  -16.543160     2  5320
5323  5322  H      2.245173   29.579630  -17.917486     2  5320
5324  5323  O     -1.287508    2.698952   -1.328281     1  5324  5325
5325  5324  H     -1.575243    1.838574   -1.633554     2  5323
5326  5325  H     -0.868000    3.096399   -2.091353     2  5323
5327  5326  O     27.094001   -2.427974   22.349502     1  5327  5328
5328  5327  H     27.430342   -2.463281   23.244969     2  5326
5329  5328  H     27.568188   -1.702357   21.943475     2  5326
5330  5329  O     -4.764024    3.562635  -32.406034     1  5330  5331
5331  5330  H     -5.512938    3.136696  -31.988979     2  5329
5332  5331  H     -4.008694    3.277197  -31.891997     2  5329
5333  5332  O     -3.602279   20.984423    2.970833     1  5333  5334
5334  5333  H     -3.769018   21.750865    3.519463     2  5332
5335  5334  H     -2.671982   21.042872    2.753205     2  5332
5336  5335  O    -25.801162   10.445035  -16.079801     1  5336  5337
5337  5336  H    -25.919190    9.618670  -16.548225     2  5335
5338  5337  H    -26.079869   11.116048  -16.702934     2  5335
5339  5338  O      1.988449  -31.157863   20.814626     1  5339  5340
5340  5339  H      2.000201  -31.141660   21.771617     2  5338
5341  5340  H      2.872160  -30.893153   20.559253     2  5338
5342  5341  O     -4.595051    6.457214   -4.728962     1  5342  5343
5343  5342  H     -4.572359    6.910481   -3.886189     2  5341
5344  5343  H     -5.380650    5.911948   -4.687123     2  5341
5345  5344  O    -13.457476   19.812377   -8.654633     1  5345  5346
5346  5345  H    -14.302862   20.053143   -8.275705     2  5344
5347  5346  H    -13.680098   19.322877   -9.446504     2  5344
5348  5347  O     -3.733123   19.879897   -8.434681     1  5348  5349
5349  5348  H     -2.870293   19.732046   -8.047518     2  5347
5350  5349  H     -4.283139   20.149710   -7.699212     2  5347
5351  5350  O    -24.350519   11.445499   -7.725147     1  5351  5352
5352  5351  H    -24.051466   11.756538   -6.870714     2  5350
5353  5352  H    -24.087824   12.133639   -8.336446     2  5350
5354  5353  O    -14.238997    3.299598  -27.631450     1  5354  5355
5355  5354  H    -14.696436    3.472707  -26.808641     2  5353
5356  5355  H    -13.677740    4.064337  -27.759497     2  5353
5357  5356  O    -23.815710    5.201457   -6.730822     1  5357  5358
5358  5357  H    -23.980342    4.343060   -7.121055     2  5356
5359  5358  H    -24.576808    5.727052   -6.977219     2  5356
5360  5359  O    -18.687203    6.935113   -1.063983     1  5360  5361
5361  5360  H    -19.485796    7.459862   -1.008144     2  5359
5362  5361  H    -18.012085    7.554317   -1.341534     2  5359
5363  5362  O     -3.251532   31.767087   -2.634523     1  5363  5364
5364  5363  H     -2.353863   32.091771   -2.705251     2  5362
5365  5364  H     -3.211905   30.874952   -2.979132     2  5362
5366  5365  O    -22.829601   13.406640   -2.426211     1  5366  5367
5367  5366  H    -23.629379   13.071834   -2.831785     2  5365
5368  5367  H    -22.905754   14.358305   -2.495252     2  5365
5369  5368  O    -29.913938   17.645195   -4.212520     1  5369  5370
5370  5369  H    -30.231939   18.466204   -4.588088     2  5368
5371  5370  H    -30.566428   16.994354   -4.471161     2  5368
5372  5371  O    -19.579160   -2.204526  -26.627927     1  5372  5373
5373  5372  H    -19.607131   -3.026143  -26.137626     2  5371
5374  5373  H    -19.623041   -2.471380  -27.546129     2  5371
5375  5374  O    -11.044848  -34.551697   -3.607168     1  5375  5376
5376  5375  H    -11.750778  -34.444313   -4.244634     2  5374
5377  5376  H    -10.251028  -34.620880   -4.137540     2  5374
5378  5377  O    -13.177067   24.429747  -15.191723     1  5378  5379
5379  5378  H    -13.111533   23.913539  -14.388314     2  5377
5380  5379  H    -12.663265   25.217439  -15.013452     2  5377
5381  5380  O    -25.607275    2.009144  -20.880805     1  5381  5382
5382  5381  H    -25.200960    2.603720  -21.511375     2  5380
5383  5382  H    -26.458344    1.797564  -21.264404     2  5380
5384  5383  O    -27.200724    0.852832    1.271787     1  5384  5385
5385  5384  H    -26.738436    1.663789    1.059957     2  5383
5386  5385  H    -27.591829    0.576065    0.443133     2  5383
5387  5386  O      5.772193   21.160477   -1.708991     1  5387  5388
5388  5387  H      6.013074   22.016024   -2.064305     2  5386
5389  5388  H      5.300456   20.728942   -2.421363     2  5386
5390  5389  O     -8.023872   23.640244  -17.828225     1  5390  5391
5391  5390  H     -8.205865   24.485113  -18.239695     2  5389
5392  5391  H     -8.738775   23.073369  -18.117704     2  5389
5393  5392  O    -22.663173   16.185491   -2.537625     1  5393  5394
5394  5393  H    -23.203047   16.967934   -2.649653     2  5392
5395  5394  H    -21.785308   16.523076   -2.359805     2  5392
5396  5395  O    -16.460373   25.709486   -0.029320     1  5396  5397
5397  5396  H    -15.764287   25.672953   -0.685338     2  5395
5398  5397  H    -16.976185   26.479266   -0.269337     2  5395
5399  5398  O    -21.816286   13.421202   -9.629139     1  5399  5400
5400  5399  H    -21.646220   14.142523   -9.023329     2  5398
5401  5400  H    -22.666531   13.628741  -10.016751     2  5398
5402  5401  O    -24.184795    7.631159    0.593116     1  5402  5403
5403  5402  H    -24.811622    7.891581    1.268023     2  5401
5404  5403  H    -23.413981    8.173814    0.759260     2  5401
5405  5404  O    -19.114155    4.207426  -12.671664     1  5405  5406
5406  5405  H    -18.950955    3.306400  -12.392829     2  5404
5407  5406  H    -19.335510    4.672042  -11.864592     2  5404
5408  5407  O     -9.133148    5.171016  -21.497100     1  5408  5409
5409  5408  H     -9.114138    4.221723  -21.375805     2  5407
5410  5409  H     -9.073920    5.293118  -22.444631     2  5407
5411  5410  O     -1.909135   20.346692  -14.642883     1  5411  5412
5412  5411  H     -2.577571   19.827948  -14.195301     2  5410
5413  5412  H     -2.153520   20.306658  -15.567493     2  5410
5414  5413  O     -7.194307   15.351809   -3.058809     1  5414  5415
5415  5414  H     -7.852570   16.021109   -2.871838     2  5413
5416  5415  H     -7.324941   14.690316   -2.379402     2  5413
5417  5416  O    -11.789491   33.950191   -4.359847     1  5417  5418
5418  5417  H    -10.838747   33.879314   -4.274445     2  5416
5419  5418  H    -12.118221   33.087876   -4.105719     2  5416
5420  5419  O    -14.375427   12.539503    1.476461     1  5420  5421
5421  5420  H    -14.674628   11.730330    1.891129     2  5419
5422  5421  H    -14.813847   12.549485    0.625626     2  5419
5423  5422  O    -31.281410    4.864205  -11.221336     1  5423  5424
5424  5423  H    -31.006685    5.742385  -10.957599     2  5422
5425  5424  H    -31.222081    4.343508  -10.420344     2  5422
5426  5425  O      7.615798   -6.633664  -33.863996     1  5426  5427
5427  5426  H      6.662327   -6.633732  -33.779580     2  5425
5428  5427  H      7.917572   -7.228200  -33.177199     2  5425
5429  5428  O     -8.685046   32.844744   -1.069532     1  5429  5430
5430  5429  H     -7.778958   33.103522   -0.901397     2  5428
5431  5430  H     -9.176365   33.194372   -0.326163     2  5428
5432  5431  O     -0.827839   22.169377  -25.830842     1  5432  5433
5433  5432  H     -1.657721   21.860045  -25.467742     2  5431
5434  5433  H     -0.681704   21.617816  -26.599384     2  5431
5435  5434  O    -29.430199    1.776718  -18.387675     1  5435  5436
5436  5435  H    -29.051632    1.874037  -17.513921     2  5434
5437  5436  H    -29.693423    2.663085  -18.635261     2  5434
5438  5437  O    -19.509881    6.251625   -3.572795     1  5438  5439
5439  5438  H    -19.018918    6.902637   -4.074163     2  5437
5440  5439  H    -19.419161    6.531772   -2.662016     2  5437
5441  5440  O    -32.536190   11.409359   -6.365089     1  5441  5442
5442  5441  H    -32.100571   11.647329   -5.546652     2  5440
5443  5442  H    -31.843837   11.024304   -6.902315     2  5440
5444  5443  O    -21.239123    6.152797    3.357988     1  5444  5445
5445  5444  H    -21.141679    7.089970    3.189335     2  5443
5446  5445  H    -22.094825    6.072484    3.779361     2  5443
5447  5446  O     34.896227  -12.145509    1.158457     1  5447  5448
5448  5447  H     34.413911  -12.022942    0.340789     2  5446
5449  5448  H     34.407569  -12.822815    1.626113     2  5446
5450  5449  O    -24.980317    1.330816   -4.902813     1  5450  5451
5451  5450  H    -25.198726    0.688953   -4.227135     2  5449
5452  5451  H    -24.541037    2.037421   -4.429554     2  5449
5453  5452  O    -12.537280   31.250437   -2.635393     1  5453  5454
5454  5453  H    -13.365201   31.723504   -2.718972     2  5452
5455  5454  H    -12.439960   31.101332   -1.694899     2  5452
5456  5455  O    -25.690642   15.085097   -1.458354     1  5456  5457
5457  5456  H    -26.329921   14.804602   -0.803467     2  5455
5458  5457  H    -25.083774   15.646736   -0.976166     2  5455
5459  5458  O    -21.042384    8.799509  -15.165951     1  5459  5460
5460  5459  H    -21.766017    8.936489  -14.554540     2  5458
5461  5460  H    -20.523444    8.099085  -14.770554     2  5458
5462  5461  O     -3.886717   18.789117  -13.247622     1  5462  5463
5463  5462  H     -4.766849   19.087155  -13.477344     2  5461
5464  5463  H     -4.000997   17.871508  -13.000303     2  5461
5465  5464  O    -14.073082    7.999618  -16.796143     1  5465  5466
5466  5465  H    -14.826606    8.016219  -17.386193     2  5464
5467  5466  H    -13.519009    7.296090  -17.134201     2  5464
5468  5467  O     -8.469358   19.610926  -21.849338     1  5468  5469
5469  5468  H     -7.757122   19.408398  -21.242763     2  5467
5470  5469  H     -8.383217   18.960550  -22.546347     2  5467
5471  5470  O    -13.259160   32.262049   -6.610884     1  5471  5472
5472  5471  H    -12.429712   31.834413   -6.823897     2  5470
5473  5472  H    -13.516989   31.881024   -5.771494     2  5470
5474  5473  O     -4.745821   23.681930  -13.354523     1  5474  5475
5475  5474  H     -4.129169   23.147806  -12.853840     2  5473
5476  5475  H     -4.259015   23.940462  -14.137091     2  5473
5477  5476  O    -28.318040   -2.832681   -5.241565     1  5477  5478
5478  5477  H    -28.385413   -2.519763   -6.143660     2  5476
5479  5478  H    -28.113675   -3.764058   -5.325257     2  5476
5480  5479  O    -31.162224    3.286412   -2.491006     1  5480  5481
5481  5480  H    -30.670178    3.842454   -3.095108     2  5479
5482  5481  H    -31.957210    3.054981   -2.971286     2  5479
5483  5482  O    -18.580832    0.822086  -21.665176     1  5483  5484
5484  5483  H    -17.765931    1.304735  -21.803803     2  5482
5485  5484  H    -18.362407   -0.084576  -21.880781     2  5482
5486  5485  O     15.166701  -27.751442    5.759146     1  5486  5487
5487  5486  H     15.946113  -27.205177    5.657442     2  5485
5488  5487  H     14.510022  -27.165060    6.134861     2  5485
5489  5488  O    -19.465580   12.351966   -7.414366     1  5489  5490
5490  5489  H    -19.739935   11.471588   -7.671068     2  5488
5491  5490  H    -18.723936   12.548643   -7.986655     2  5488
5492  5491  O    -22.073035    3.080379  -10.261252     1  5492  5493
5493  5492  H    -22.348663    3.996989  -10.270541     2  5491
5494  5493  H    -22.855020    2.592010  -10.518597     2  5491
5495  5494  O    -23.615233    3.601720   -4.146662     1  5495  5496
5496  5495  H    -23.367619    3.938784   -3.285671     2  5494
5497  5496  H    -23.730965    4.383761   -4.686338     2  5494
5498  5497  O    -24.750502   13.248600  -10.225611     1  5498  5499
5499  5498  H    -25.254776   13.791326   -9.619486     2  5497
5500  5499  H    -25.399861   12.910926  -10.842492     2  5497
5501  5500  O     -3.511107   16.769512  -16.419413     1  5501  5502
5502  5501  H     -3.289911   17.355508  -17.143232     2  5500
5503  5502  H     -2.690952   16.320237  -16.215139     2  5500
5504  5503  O      9.570452  -21.238453   22.696343     1  5504  5505
5505  5504  H      9.084036  -20.602504   22.171747     2  5503
5506  5505  H      8.898760  -21.697144   23.200985     2  5503
5507  5506  O     -9.568853    7.428812   -8.477019     1  5507  5508
5508  5507  H     -8.721900    7.438896   -8.031149     2  5506
5509  5508  H     -9.712471    6.508757   -8.698611     2  5506
5510  5509  O     -8.575974   -4.642023  -27.002083     1  5510  5511
5511  5510  H     -8.810708   -4.166824  -27.799151     2  5509
5512  5511  H     -7.657900   -4.882154  -27.127414     2  5509
5513  5512  O     -4.998281    8.799625   -6.561845     1  5513  5514
5514  5513  H     -5.717187    8.167886   -6.579485     2  5512
5515  5514  H     -4.237362    8.289585   -6.284187     2  5512
5516  5515  O      1.491413    4.607952  -27.968068     1  5516  5517
5517  5516  H      1.881293    5.108086  -27.251067     2  5515
5518  5517  H      1.932936    3.759250  -27.936535     2  5515
5519  5518  O    -16.579771   21.812740  -14.924579     1  5519  5520
5520  5519  H    -16.657872   21.339898  -15.753164     2  5518
5521  5520  H    -15.787347   21.459329  -14.520355     2  5518
5522  5521  O     -7.006262   -0.101857  -31.718425     1  5522  5523
5523  5522  H     -7.122648    0.843251  -31.621182     2  5521
5524  5523  H     -7.785833   -0.392196  -32.191927     2  5521
5525  5524  O    -16.765131    8.814188   -1.588814     1  5525  5526
5526  5525  H    -16.102945    8.755434   -0.900127     2  5524
5527  5526  H    -17.026207    9.735087   -1.592777     2  5524
5528  5527  O    -12.588793   15.014784  -13.205051     1  5528  5529
5529  5528  H    -13.188437   15.738618  -13.385944     2  5527
5530  5529  H    -12.440838   14.606782  -14.058207     2  5527
5531  5530  O    -13.625244   24.024639   -4.390161     1  5531  5532
5532  5531  H    -14.203776   24.771417   -4.544617     2  5530
5533  5532  H    -12.889138   24.388967   -3.898587     2  5530
5534  5533  O     -0.205285  -31.707308   -9.684772     1  5534  5535
5535  5534  H     -0.810475  -32.446748   -9.628160     2  5533
5536  5535  H     -0.689235  -30.971805   -9.309193     2  5533
5537  5536  O    -22.809998   10.403760    4.473254     1  5537  5538
5538  5537  H    -21.942459   10.526648    4.858619     2  5536
5539  5538  H    -22.772224   10.876017    3.641522     2  5536
5540  5539  O    -27.609839   10.132791    0.730229     1  5540  5541
5541  5540  H    -27.447794    9.461331    1.392887     2  5539
5542  5541  H    -28.436313   10.536665    0.994913     2  5539
5543  5542  O     -2.271286   21.769052  -12.366685     1  5543  5544
5544  5543  H     -2.058281   21.488169  -13.256609     2  5542
5545  5544  H     -2.322172   20.955995  -11.864113     2  5542
5546  5545  O    -18.850016   16.233992  -13.142985     1  5546  5547
5547  5546  H    -18.328012   15.889022  -13.867373     2  5545
5548  5547  H    -19.269905   15.463106  -12.761332     2  5545
5549  5548  O      9.383534  -34.048041    2.465470     1  5549  5550
5550  5549  H      8.431175  -34.073611    2.372793     2  5548
5551  5550  H      9.575817  -34.692961    3.146158     2  5548
5552  5551  O      1.820401   19.186433  -27.899979     1  5552  5553
5553  5552  H      1.906357   18.545778  -28.605957     2  5551
5554  5553  H      1.150692   19.796265  -28.209538     2  5551
5555  5554  O    -14.409929   -3.102840  -23.388363     1  5555  5556
5556  5555  H    -14.620399   -2.364741  -23.960328     2  5554
5557  5556  H    -13.784451   -3.624995  -23.890720     2  5554
5558  5557  O     -4.431409   10.333945   -3.899819     1  5558  5559
5559  5558  H     -4.642271    9.887458   -4.719830     2  5557
5560  5559  H     -3.552358   10.686733   -4.037813     2  5557
5561  5560  O    -14.502802    4.602341   -2.152885     1  5561  5562
5562  5561  H    -14.911595    5.239838   -2.738306     2  5560
5563  5562  H    -14.116739    3.951390   -2.738931     2  5560
5564  5563  O     -5.942747   17.213512  -15.948611     1  5564  5565
5565  5564  H     -4.989360   17.138787  -15.989837     2  5563
5566  5565  H     -6.240616   16.342504  -15.686216     2  5563
5567  5566  O     -7.407230   30.701247   -3.216823     1  5567  5568
5568  5567  H     -7.035137   30.255151   -2.456049     2  5566
5569  5568  H     -8.343572   30.759316   -3.026760     2  5566
5570  5569  O     -7.945791    7.775514  -25.705819     1  5570  5571
5571  5570  H     -7.066702    7.397148  -25.722359     2  5569
5572  5571  H     -7.902625    8.509713  -26.318453     2  5569
5573  5572  O    -10.986389   15.583387   -2.634600     1  5573  5574
5574  5573  H    -11.793206   16.098410   -2.629225     2  5572
5575  5574  H    -10.991788   15.120156   -1.796973     2  5572
5576  5575  O     -7.085288   10.634410  -22.686691     1  5576  5577
5577  5576  H     -6.714212   10.788543  -23.555471     2  5575
5578  5577  H     -6.406454   10.929799  -22.079928     2  5575
5579  5578  O    -17.878051   11.306382   -2.325959     1  5579  5580
5580  5579  H    -18.695826   11.801327   -2.376005     2  5578
5581  5580  H    -17.430051   11.499189   -3.149581     2  5578
5582  5581  O    -14.707913    8.896661   -7.526694     1  5582  5583
5583  5582  H    -13.829092    8.660742   -7.823759     2  5581
5584  5583  H    -14.684031    9.849585   -7.439536     2  5581
5585  5584  O    -15.964171   11.841166  -12.543081     1  5585  5586
5586  5585  H    -15.571545   12.649614  -12.872459     2  5584
5587  5586  H    -15.527803   11.145012  -13.034186     2  5584
5588  5587  O     -6.740689   13.145206  -21.112319     1  5588  5589
5589  5588  H     -7.183350   13.904594  -20.733356     2  5587
5590  5589  H     -6.977329   13.167480  -22.039538     2  5587
5591  5590  O     -7.981775    4.682559  -15.068185     1  5591  5592
5592  5591  H     -7.148456    4.710637  -15.538316     2  5590
5593  5592  H     -8.374412    3.848331  -15.325346     2  5590
5594  5593  O    -26.729276   12.357741  -11.868623     1  5594  5595
5595  5594  H    -26.489391   11.443495  -12.019759     2  5593
5596  5595  H    -27.658918   12.402057  -12.092305     2  5593
5597  5596  O     -5.203090   14.484128  -14.190788     1  5597  5598
5598  5597  H     -4.668827   13.709641  -14.366754     2  5596
5599  5598  H     -6.077707   14.137369  -14.014617     2  5596
5600  5599  O    -15.376427    3.310625  -24.834527     1  5600  5601
5601  5600  H    -16.328976    3.336580  -24.925127     2  5599
5602  5601  H    -15.113390    4.230366  -24.801061     2  5599
5603  5602  O    -11.525906   -5.398716  -27.390337     1  5603  5604
5604  5603  H    -10.788841   -5.313105  -27.995015     2  5602
5605  5604  H    -12.224714   -4.879935  -27.788791     2  5602
5606  5605  O     26.674061   -6.161069   19.301896     1  5606  5607
5607  5606  H     27.263660   -5.705856   19.903049     2  5605
5608  5607  H     27.232621   -6.422342   18.569790     2  5605
5609  5608  O    -17.900421    2.921555  -27.402090     1  5609  5610
5610  5609  H    -17.284630    3.640192  -27.545602     2  5608
5611  5610  H    -17.736629    2.317003  -28.125913     2  5608
5612  5611  O     -3.684181    3.668298  -15.701229     1  5612  5613
5613  5612  H     -3.039120    4.372240  -15.768996     2  5611
5614  5613  H     -4.494856    4.052727  -16.034775     2  5611
5615  5614  O    -11.292852   10.393767   -7.423560     1  5615  5616
5616  5615  H    -12.133115   10.845799   -7.500099     2  5614
5617  5616  H    -10.639401   11.091147   -7.477348     2  5614
5618  5617  O     -2.052276    7.870847   -6.629665     1  5618  5619
5619  5618  H     -2.013031    6.927874   -6.789332     2  5617
5620  5619  H     -2.456575    8.231263   -7.418889     2  5617
5621  5620  O     -3.510694   13.576341    1.413656     1  5621  5622
5622  5621  H     -3.706134   13.690798    0.483638     2  5620
5623  5622  H     -2.624714   13.214392    1.429927     2  5620
5624  5623  O     31.495231  -14.878376    4.922173     1  5624  5625
5625  5624  H     30.832244  -14.412869    4.412286     2  5623
5626  5625  H     31.613552  -14.343531    5.707139     2  5623
5627  5626  O    -17.297544    5.681857  -10.539746     1  5627  5628
5628  5627  H    -17.381847    6.603387  -10.294987     2  5626
5629  5628  H    -16.848640    5.698146  -11.384999     2  5626
5630  5629  O     -5.991028   21.005948    1.679949     1  5630  5631
5631  5630  H     -5.226971   21.009098    2.256524     2  5629
5632  5631  H     -5.878480   20.225952    1.136652     2  5629
5633  5632  O     -1.544899    3.530163  -24.541961     1  5633  5634
5634  5633  H     -0.725623    3.845736  -24.160606     2  5632
5635  5634  H     -1.789187    2.780527  -23.999190     2  5632
5636  5635  O    -17.986801    0.822131  -31.064719     1  5636  5637
5637  5636  H    -18.295841    0.797779  -30.159107     2  5635
5638  5637  H    -18.388277    0.056674  -31.475965     2  5635
5639  5638  O    -19.163360   12.393558  -21.262238     1  5639  5640
5640  5639  H    -19.379634   11.595480  -21.744451     2  5638
5641  5640  H    -18.295015   12.639013  -21.581550     2  5638
5642  5641  O    -11.584182   18.230109   -7.281759     1  5642  5643
5643  5642  H    -12.030525   18.735952   -7.960826     2  5641
5644  5643  H    -10.803380   17.884363   -7.714241     2  5641
5645  5644  O     -4.401487    6.125204  -35.787984     1  5645  5646
5646  5645  H     -3.954855    5.279556  -35.828353     2  5644
5647  5646  H     -4.674499    6.209044  -34.874383     2  5644
5648  5647  O    -12.673439    1.322542  -31.622162     1  5648  5649
5649  5648  H    -12.182566    0.560472  -31.314715     2  5647
5650  5649  H    -12.023480    2.023664  -31.669191     2  5647
5651  5650  O     -6.531054    8.399854   -9.271884     1  5651  5652
5652  5651  H     -6.931345    8.018200  -10.053126     2  5650
5653  5652  H     -7.017229    9.211226   -9.125113     2  5650
5654  5653  O    -15.988296    6.869011   -6.130426     1  5654  5655
5655  5654  H    -16.923094    6.922507   -6.329230     2  5653
5656  5655  H    -15.575377    7.463818   -6.756473     2  5653
5657  5656  O     -7.686542   30.270881   -8.313090     1  5657  5658
5658  5657  H     -7.463613   30.796301   -9.081509     2  5656
5659  5658  H     -8.235705   29.565685   -8.655654     2  5656
5660  5659  O     -3.711150   29.374753   -4.031275     1  5660  5661
5661  5660  H     -3.140869   29.970667   -4.516968     2  5659
5662  5661  H     -4.406539   29.150695   -4.649712     2  5659
5663  5662  O     -4.679660   19.411560   -0.198642     1  5663  5664
5664  5663  H     -4.936312   20.219968   -0.642304     2  5662
5665  5664  H     -4.911716   18.716033   -0.813966     2  5662
5666  5665  O     -8.544598    4.439195  -24.379132     1  5666  5667
5667  5666  H     -8.591732    5.307029  -24.780224     2  5665
5668  5667  H     -7.971652    3.937574  -24.959082     2  5665
5669  5668  O     -9.095194   13.613355  -15.715297     1  5669  5670
5670  5669  H     -8.652014   13.490935  -16.554843     2  5668
5671  5670  H     -9.858388   13.037407  -15.760571     2  5668
5672  5671  O    -17.224549    3.619620  -30.257888     1  5672  5673
5673  5672  H    -16.312635    3.699273  -30.537711     2  5671
5674  5673  H    -17.504025    2.766698  -30.590527     2  5671
5675  5674  O     -6.190513   12.341008  -16.361158     1  5675  5676
5676  5675  H     -5.813064   11.518279  -16.049901     2  5674
5677  5676  H     -6.949303   12.485937  -15.795945     2  5674
5678  5677  O     30.308443  -17.675444    5.812075     1  5678  5679
5679  5678  H     29.527405  -17.473866    6.327418     2  5677
5680  5679  H     30.711499  -16.823663    5.644004     2  5677
5681  5680  O    -27.665973    8.722014   -6.573074     1  5681  5682
5682  5681  H    -27.101574    8.108970   -6.102051     2  5680
5683  5682  H    -27.910091    9.375542   -5.917682     2  5680
5684  5683  O     -3.412937  -35.889840   -0.366761     1  5684  5685
5685  5684  H     -2.630936  -35.742043    0.165086     2  5683
5686  5685  H     -3.825038  -36.661529    0.021697     2  5683
5687  5686  O     22.546859  -25.852211    4.647402     1  5687  5688
5688  5687  H     22.870858  -26.641505    4.213500     2  5686
5689  5688  H     23.244036  -25.207815    4.525214     2  5686
5690  5689  O     -4.004720   10.829051   -8.470029     1  5690  5691
5691  5690  H     -4.306801   10.141044   -7.877050     2  5689
5692  5691  H     -4.598020   10.777556   -9.219413     2  5689
5693  5692  O     -0.511577  -34.645575   -1.806202     1  5693  5694
5694  5693  H     -0.896528  -35.521690   -1.784610     2  5692
5695  5694  H     -0.582596  -34.329970   -0.905324     2  5692
5696  5695  O     -3.939073   13.179091  -26.858139     1  5696  5697
5697  5696  H     -4.631584   13.552166  -27.403552     2  5695
5698  5697  H     -3.932184   12.248519  -27.082240     2  5695
5699  5698  O     35.428144    7.556392    1.290630     1  5699  5700
5700  5699  H     35.191807    7.362869    0.383478     2  5698
5701  5700  H     35.440362    6.702421    1.722852     2  5698
5702  5701  O    -12.340310    5.998717  -17.614838     1  5702  5703
5703  5702  H    -12.039453    5.433563  -18.326399     2  5701
5704  5703  H    -11.931636    5.634252  -16.829738     2  5701
5705  5704  O    -22.351066    4.637831  -20.536962     1  5705  5706
5706  5705  H    -22.795032    3.947903  -21.030040     2  5704
5707  5706  H    -21.624477    4.192052  -20.101552     2  5704
5708  5707  O    -11.746222    8.345906  -19.247056     1  5708  5709
5709  5708  H    -12.029782    7.747302  -18.556044     2  5707
5710  5709  H    -11.620687    7.785878  -20.013112     2  5707
5711  5710  O     31.326471    6.065503   -3.369938     1  5711  5712
5712  5711  H     31.686457    5.306018   -3.828004     2  5710
5713  5712  H     30.433728    6.147175   -3.705453     2  5710
5714  5713  O    -12.899652   -4.945612  -24.966827     1  5714  5715
5715  5714  H    -13.187303   -4.822985  -25.871510     2  5713
5716  5715  H    -11.985829   -4.660735  -24.964851     2  5713
5717  5716  O    -28.431040   12.833730   -4.486879     1  5717  5718
5718  5717  H    -28.817742   13.663077   -4.767729     2  5716
5719  5718  H    -28.365051   12.909860   -3.534996     2  5716
5720  5719  O    -18.098985    0.259414    5.715435     1  5720  5721
5721  5720  H    -17.993473   -0.642820    5.413652     2  5719
5722  5721  H    -19.039637    0.353859    5.865389     2  5719
5723  5722  O    -14.329581    2.021606   -7.210859     1  5723  5724
5724  5723  H    -14.943732    2.691459   -6.910281     2  5722
5725  5724  H    -14.634598    1.213723   -6.797916     2  5722
5726  5725  O     33.068271   11.574461   -2.121401     1  5726  5727
5727  5726  H     32.175566   11.718117   -2.435522     2  5725
5728  5727  H     33.472713   11.023432   -2.791493     2  5725
5729  5728  O    -10.402464   10.645682  -18.910110     1  5729  5730
5730  5729  H    -11.150900   10.053008  -18.979490     2  5728
5731  5730  H    -10.191336   10.872672  -19.815721     2  5728
5732  5731  O     -9.287278   15.457922  -27.349416     1  5732  5733
5733  5732  H     -9.034688   14.534660  -27.353502     2  5731
5734  5733  H     -8.478429   15.928907  -27.549832     2  5731
5735  5734  O    -19.950314    0.202909   -6.722879     1  5735  5736
5736  5735  H    -20.394856   -0.110840   -5.935367     2  5734
5737  5736  H    -20.128623    1.143187   -6.740619     2  5734
5738  5737  O    -24.821965   -2.857806   -2.794678     1  5738  5739
5739  5738  H    -24.763566   -2.120589   -2.186950     2  5737
5740  5739  H    -25.631834   -3.306109   -2.551021     2  5737
5741  5740  O    -29.147402    3.853073  -12.843074     1  5741  5742
5742  5741  H    -29.882633    4.452621  -12.715761     2  5740
5743  5742  H    -29.143596    3.307571  -12.056534     2  5740
5744  5743  O     -1.131006    8.704350  -32.681074     1  5744  5745
5745  5744  H     -0.181964    8.802243  -32.758322     2  5743
5746  5745  H     -1.422436    8.484777  -33.565996     2  5743
5747  5746  O    -34.654493   -3.127592   11.310938     1  5747  5748
5748  5747  H    -34.036432   -3.533086   10.702820     2  5746
5749  5748  H    -34.840278   -2.270169   10.928133     2  5746
5750  5749  O     -7.879365   14.266810   -0.604682     1  5750  5751
5751  5750  H     -8.822955   14.171055   -0.475454     2  5749
5752  5751  H     -7.512226   13.429168   -0.322199     2  5749
5753  5752  O     11.745002  -16.856238   18.363479     1  5753  5754
5754  5753  H     10.987215  -17.393615   18.594167     2  5752
5755  5754  H     11.873631  -16.285067   19.120744     2  5752
5756  5755  O     20.888410   -1.943869   22.575411     1  5756  5757
5757  5756  H     21.249423   -2.083448   23.450864     2  5755
5758  5757  H     21.006272   -2.783199   22.130591     2  5755
5759  5758  O     -6.701518   22.105152   -7.897373     1  5759  5760
5760  5759  H     -7.109961   21.276171   -7.647978     2  5758
5761  5760  H     -7.036356   22.738279   -7.262341     2  5758
5762  5761  O    -14.650876    7.819460  -25.362397     1  5762  5763
5763  5762  H    -14.677326    8.326553  -24.550985     2  5761
5764  5763  H    -15.499565    7.378174  -25.397388     2  5761
5765  5764  O     -4.035348   12.081402  -21.744124     1  5765  5766
5766  5765  H     -4.858489   12.529770  -21.550124     2  5764
5767  5766  H     -3.580255   12.666564  -22.349688     2  5764
5768  5767  O      0.981861   13.430742   -1.924299     1  5768  5769
5769  5768  H      0.312025   12.757573   -2.044274     2  5767
5770  5769  H      0.496769   14.202732   -1.632836     2  5767
5771  5770  O    -19.510522   25.716132    4.146141     1  5771  5772
5772  5771  H    -19.390745   25.301296    5.000422     2  5770
5773  5772  H    -18.696018   25.537312    3.676207     2  5770
5774  5773  O     -3.248582    9.718004  -20.433048     1  5774  5775
5775  5774  H     -3.452143   10.564474  -20.830897     2  5773
5776  5775  H     -4.077379    9.425536  -20.053854     2  5773
5777  5776  O     -0.811609   31.352162  -14.355646     1  5777  5778
5778  5777  H     -1.637141   31.552457  -14.796793     2  5776
5779  5778  H     -0.986039   30.542242  -13.876235     2  5776
5780  5779  O     -3.801418    7.547189  -17.379502     1  5780  5781
5781  5780  H     -4.009082    6.967937  -18.112696     2  5779
5782  5781  H     -3.286460    7.003965  -16.782878     2  5779
5783  5782  O     -0.914212   28.814185  -18.119252     1  5783  5784
5784  5783  H      0.021851   28.842470  -17.921217     2  5782
5785  5784  H     -0.968268   28.356863  -18.958398     2  5782
5786  5785  O    -18.166128    8.065308  -21.927490     1  5786  5787
5787  5786  H    -19.075492    8.333993  -22.058251     2  5785
5788  5787  H    -18.220653    7.137765  -21.697438     2  5785
5789  5788  O     -8.870656    7.260129   -4.593844     1  5789  5790
5790  5789  H     -9.459461    7.881207   -5.022563     2  5788
5791  5790  H     -8.217674    7.048751   -5.261052     2  5788
5792  5791  O    -20.543160    8.624288  -24.227582     1  5792  5793
5793  5792  H    -20.024656    8.102955  -24.840441     2  5791
5794  5793  H    -21.073221    7.982360  -23.755147     2  5791
5795  5794  O     -9.616738   17.304678    4.522944     1  5795  5796
5796  5795  H    -10.298589   16.660856    4.714789     2  5794
5797  5796  H     -8.927670   16.802192    4.088289     2  5794
5798  5797  O    -14.257535   32.947808    5.068071     1  5798  5799
5799  5798  H    -13.589150   33.439928    4.591299     2  5797
5800  5799  H    -14.899758   32.706569    4.400550     2  5797
5801  5800  O     -6.620189  -36.053899   -2.038332     1  5801  5802
5802  5801  H     -6.412893  -36.863751   -1.572072     2  5800
5803  5802  H     -6.462024  -35.360763   -1.397413     2  5800
5804  5803  O     -6.225403   12.093833   -2.560555     1  5804  5805
5805  5804  H     -5.686712   11.319266   -2.722078     2  5803
5806  5805  H     -6.155340   12.242489   -1.617568     2  5803
5807  5806  O     -5.928138    7.962839  -33.300761     1  5807  5808
5808  5807  H     -5.299216    8.652284  -33.513724     2  5806
5809  5808  H     -5.389212    7.230198  -33.002388     2  5806
5810  5809  O    -15.131896   29.958267   -8.091661     1  5810  5811
5811  5810  H    -15.385341   29.189087   -8.601915     2  5809
5812  5811  H    -14.264376   29.743614   -7.748785     2  5809
5813  5812  O    -19.843336    1.114936  -13.300445     1  5813  5814
5814  5813  H    -19.209451    1.316861  -12.612225     2  5812
5815  5814  H    -19.565727    0.264265  -13.640332     2  5812
5816  5815  O     -1.893792   18.395698  -26.093961     1  5816  5817
5817  5816  H     -2.410691   18.438368  -26.898465     2  5815
5818  5817  H     -1.734808   17.461329  -25.960130     2  5815
5819  5818  O     -3.971982    6.229045  -32.646726     1  5819  5820
5820  5819  H     -3.343436    6.513778  -31.983335     2  5818
5821  5820  H     -4.112210    5.300450  -32.461579     2  5818
5822  5821  O      0.852454   16.326352    1.941944     1  5822  5823
5823  5822  H     -0.071870   16.235375    2.173419     2  5821
5824  5823  H      1.207578   16.922001    2.601732     2  5821
5825  5824  O    -10.504812   25.367529   -5.932264     1  5825  5826
5826  5825  H    -11.183538   25.181280   -5.283517     2  5824
5827  5826  H    -10.882446   25.080774   -6.763766     2  5824
5828  5827  O    -26.117464    9.418004  -10.271771     1  5828  5829
5829  5828  H    -25.998391    9.372443   -9.323099     2  5827
5830  5829  H    -26.648630   10.202288  -10.409581     2  5827
5831  5830  O     -4.307357   20.163771  -26.847484     1  5831  5832
5832  5831  H     -5.257841   20.274548  -26.824208     2  5830
5833  5832  H     -4.046083   20.138454  -25.926980     2  5830
5834  5833  O    -18.458874    3.230475  -24.680020     1  5834  5835
5835  5834  H    -18.563804    3.197584  -25.630883     2  5833
5836  5835  H    -18.992980    2.505938  -24.354430     2  5833
5837  5836  O     -5.813911   22.181188  -19.464898     1  5837  5838
5838  5837  H     -5.405126   23.036665  -19.333424     2  5836
5839  5838  H     -5.086605   21.559840  -19.430505     2  5836
5840  5839  O     -8.279890    8.161994  -31.830574     1  5840  5841
5841  5840  H     -9.006730    8.625563  -32.246553     2  5839
5842  5841  H     -7.600646    8.127074  -32.504102     2  5839
5843  5842  O     -9.207091   16.037900  -14.209977     1  5843  5844
5844  5843  H     -9.495410   15.218342  -14.611759     2  5842
5845  5844  H     -9.743372   16.120261  -13.421401     2  5842
5846  5845  O    -14.899511   -0.771061  -24.812021     1  5846  5847
5847  5846  H    -14.287407   -0.199698  -25.275815     2  5845
5848  5847  H    -15.739354   -0.314652  -24.862862     2  5845
5849  5848  O     -0.376140    7.276982  -24.596597     1  5849  5850
5850  5849  H     -0.865670    7.160390  -23.782349     2  5848
5851  5850  H     -1.044246    7.265885  -25.281975     2  5848
5852  5851  O    -30.392178    7.546191  -11.656613     1  5852  5853
5853  5852  H    -29.450866    7.671823  -11.776532     2  5851
5854  5853  H    -30.571281    7.893662  -10.782876     2  5851
5855  5854  O    -14.090958    7.883401  -10.666893     1  5855  5856
5856  5855  H    -14.808664    8.496219  -10.506944     2  5854
5857  5856  H    -13.341575    8.440872  -10.876377     2  5854
5858  5857  O     -5.900139    2.292540  -34.707407     1  5858  5859
5859  5858  H     -4.978610    2.036865  -34.666829     2  5857
5860  5859  H     -5.939757    3.123385  -34.233741     2  5857
5861  5860  O     18.993839  -27.635850    7.259375     1  5861  5862
5862  5861  H     19.301712  -28.118791    6.492424     2  5860
5863  5862  H     18.498924  -28.279926    7.765791     2  5860
5864  5863  O    -11.750899   10.367109   -2.320629     1  5864  5865
5865  5864  H    -10.833755   10.641111   -2.319231     2  5863
5866  5865  H    -11.719364    9.424000   -2.481199     2  5863
5867  5866  O    -13.326267    5.483855  -25.696382     1  5867  5868
5868  5867  H    -12.777464    5.483457  -26.480631     2  5866
5869  5868  H    -13.629632    6.388165  -25.616219     2  5866
5870  5869  O    -18.744976   16.160731   -6.870928     1  5870  5871
5871  5870  H    -19.574794   16.032631   -7.330520     2  5869
5872  5871  H    -18.842424   17.004962   -6.430464     2  5869
5873  5872  O     -5.841029   30.306720  -15.091672     1  5873  5874
5874  5873  H     -5.680494   30.567294  -15.998623     2  5872
5875  5874  H     -6.792169   30.351467  -14.993889     2  5872
5876  5875  O     -9.573399   16.529368   -8.410303     1  5876  5877
5877  5876  H    -10.006778   16.777270   -9.226979     2  5875
5878  5877  H     -8.734195   16.160814   -8.686230     2  5875
5879  5878  O    -17.283421   24.522435   -5.899474     1  5879  5880
5880  5879  H    -16.550140   24.960396   -5.467362     2  5878
5881  5880  H    -18.039453   24.717401   -5.345728     2  5878
5882  5881  O     -2.036315    6.613688  -30.678793     1  5882  5883
5883  5882  H     -1.680972    7.423541  -31.044990     2  5881
5884  5883  H     -1.271484    6.052767  -30.549820     2  5881
5885  5884  O    -23.557527    7.456200  -16.319974     1  5885  5886
5886  5885  H    -22.710648    7.678680  -15.933284     2  5884
5887  5886  H    -24.198333    7.906596  -15.769754     2  5884
5888  5887  O     -3.944098   29.062716  -10.578915     1  5888  5889
5889  5888  H     -3.879101   29.771530   -9.938923     2  5887
5890  5889  H     -4.872491   29.032412  -10.810001     2  5887
5891  5890  O    -14.899370    9.077037    0.852404     1  5891  5892
5892  5891  H    -14.847359    8.164863    0.566987     2  5890
5893  5892  H    -13.999608    9.307890    1.083418     2  5890
5894  5893  O     -5.625829   28.895626   -6.371769     1  5894  5895
5895  5894  H     -5.937738   28.026242   -6.120539     2  5893
5896  5895  H     -6.321256   29.249057   -6.926474     2  5893
5897  5896  O     -5.563435  -34.720925    3.454045     1  5897  5898
5898  5897  H     -4.716138  -34.435880    3.796197     2  5896
5899  5898  H     -6.206495  -34.234402    3.969798     2  5896
5900  5899  O    -18.677679    3.202448  -15.497858     1  5900  5901
5901  5900  H    -19.287720    3.837282  -15.873447     2  5899
5902  5901  H    -18.794297    3.288322  -14.551678     2  5899
5903  5902  O     -6.869138    0.393414  -24.356512     1  5903  5904
5904  5903  H     -5.975430    0.058826  -24.431137     2  5902
5905  5904  H     -7.403305   -0.383583  -24.191671     2  5902
5906  5905  O    -11.230357    1.824063  -22.379670     1  5906  5907
5907  5906  H    -11.668276    1.192521  -21.809045     2  5905
5908  5907  H    -10.935783    1.306459  -23.129033     2  5905
5909  5908  O    -15.534942   13.015616   -1.157821     1  5909  5910
5910  5909  H    -15.899500   13.900275   -1.131235     2  5908
5911  5910  H    -16.175768   12.506798   -1.654488     2  5908
5912  5911  O      1.630806  -23.911716   25.405881     1  5912  5913
5913  5912  H      2.577060  -23.807987   25.305502     2  5911
5914  5913  H      1.533253  -24.579311   26.084875     2  5911
5915  5914  O     25.324366  -25.861547   -2.901808     1  5915  5916
5916  5915  H     25.580531  -24.954826   -2.733084     2  5914
5917  5916  H     25.736831  -26.362379   -2.198052     2  5914
5918  5917  O     -2.342817   24.484018  -21.015195     1  5918  5919
5919  5918  H     -2.692786   24.382975  -21.900375     2  5917
5920  5919  H     -3.116486   24.502134  -20.451867     2  5917
5921  5920  O    -17.829214   11.058658  -17.371847     1  5921  5922
5922  5921  H    -17.621977   10.676767  -18.224750     2  5920
5923  5922  H    -17.493181   10.425579  -16.737400     2  5920
5924  5923  O    -12.769162    8.170559  -27.582602     1  5924  5925
5925  5924  H    -13.278743    8.920803  -27.888693     2  5923
5926  5925  H    -13.203279    7.899531  -26.773703     2  5923
5927  5926  O     -2.884991   26.467921  -18.450993     1  5927  5928
5928  5927  H     -2.173827   26.685186  -17.848271     2  5926
5929  5928  H     -2.587779   26.794123  -19.300397     2  5926
5930  5929  O     -9.335706   25.070198  -11.521355     1  5930  5931
5931  5930  H     -9.540897   24.417749  -10.851699     2  5929
5932  5931  H     -8.534854   24.746846  -11.934043     2  5929
5933  5932  O    -12.453616   27.288077   -7.745161     1  5933  5934
5934  5933  H    -12.203805   27.622268   -8.606638     2  5932
5935  5934  H    -12.533976   26.342291   -7.868706     2  5932
5936  5935  O     27.271999  -19.509859    5.020841     1  5936  5937
5937  5936  H     26.570301  -19.380207    5.658840     2  5935
5938  5937  H     26.854596  -19.363511    4.171967     2  5935
5939  5938  O     -6.787562   19.928515  -15.761332     1  5939  5940
5940  5939  H     -6.299823   19.129381  -15.960646     2  5938
5941  5940  H     -6.882526   19.920460  -14.808889     2  5938
5942  5941  O    -13.585984   35.777781   -1.499386     1  5942  5943
5943  5942  H    -12.868441   36.121962   -2.031272     2  5941
5944  5943  H    -13.153339   35.353058   -0.758670     2  5941
5945  5944  O    -12.990532   24.367601  -12.023046     1  5945  5946
5946  5945  H    -13.005978   23.459299  -12.324677     2  5944
5947  5946  H    -12.093654   24.659471  -12.186304     2  5944
5948  5947  O     -3.978416    4.425513  -25.241974     1  5948  5949
5949  5948  H     -3.914670    5.281523  -25.665548     2  5947
5950  5949  H     -3.069920    4.161373  -25.096729     2  5947
5951  5950  O     -1.981690   19.407656  -11.140824     1  5951  5952
5952  5951  H     -2.161638   18.720093  -11.782000     2  5950
5953  5952  H     -2.812954   19.532277  -10.682892     2  5950
5954  5953  O     18.271068   -8.199759   23.019046     1  5954  5955
5955  5954  H     18.301009   -8.392572   23.956147     2  5953
5956  5955  H     19.012643   -8.680457   22.651312     2  5953
5957  5956  O     -6.133598   32.953979   -3.242718     1  5957  5958
5958  5957  H     -6.616903   32.134471   -3.137569     2  5956
5959  5958  H     -5.224219   32.722164   -3.054242     2  5956
5960  5959  O     -7.338015   20.273126  -18.187915     1  5960  5961
5961  5960  H     -7.273315   20.291190  -17.233075     2  5959
5962  5961  H     -7.164872   21.175173  -18.457293     2  5959
5963  5962  O    -12.836300    4.765684   -8.008106     1  5963  5964
5964  5963  H    -13.611853    4.385460   -7.595580     2  5962
5965  5964  H    -13.080062    4.869056   -8.927957     2  5962
5966  5965  O    -16.221366    6.435738    0.392619     1  5966  5967
5967  5966  H    -16.842294    6.057760   -0.230126     2  5965
5968  5967  H    -15.517801    5.789460    0.452245     2  5965
5969  5968  O    -31.541740    2.353649   -6.359886     1  5969  5970
5970  5969  H    -32.242417    2.442963   -5.713894     2  5968
5971  5970  H    -30.994529    1.643827   -6.023814     2  5968
5972  5971  O     -5.063730    1.393729   -5.836976     1  5972  5973
5973  5972  H     -4.797749    1.670854   -4.960227     2  5971
5974  5973  H     -4.753886    0.490821   -5.907588     2  5971
5975  5974  O     -4.088527    6.471640  -20.616593     1  5975  5976
5976  5975  H     -4.755456    7.151461  -20.520262     2  5974
5977  5976  H     -4.330092    6.010578  -21.419898     2  5974
5978  5977  O     -4.511201    5.571774  -29.695789     1  5978  5979
5979  5978  H     -4.215074    4.667972  -29.587707     2  5977
5980  5979  H     -3.720461    6.056795  -29.931830     2  5977
5981  5980  O     -9.134451   27.315887  -15.337177     1  5981  5982
5982  5981  H     -8.377187   27.385597  -15.918489     2  5980
5983  5982  H     -9.838463   27.764744  -15.805285     2  5980
5984  5983  O     19.056665  -29.427143    4.555881     1  5984  5985
5985  5984  H     18.483197  -30.174527    4.386227     2  5983
5986  5985  H     19.941227  -29.791661    4.525720     2  5983
5987  5986  O    -13.405031   27.830509   -1.520150     1  5987  5988
5988  5987  H    -12.877427   27.078072   -1.787930     2  5986
5989  5988  H    -12.969770   28.161396   -0.734469     2  5986
5990  5989  O    -12.330911    3.523653   36.260424     1  5990  5991
5991  5990  H    -13.248965    3.444659   36.001254     2  5989
5992  5991  H    -11.843663    3.113672   35.545766     2  5989
5993  5992  O     -9.643280    6.343414  -27.522419     1  5993  5994
5994  5993  H     -8.774571    6.026722  -27.769971     2  5992
5995  5994  H     -9.472016    7.075138  -26.929562     2  5992
5996  5995  O     18.874204  -34.679654   -0.016378     1  5996  5997
5997  5996  H     19.434119  -35.043708    0.669327     2  5995
5998  5997  H     18.906549  -33.733440    0.124568     2  5995
5999  5998  O    -15.533015    6.323281    4.100294     1  5999  6000
6000  5999  H    -16.075883    6.728128    3.423815     2  5998
6001  6000  H    -16.146628    5.807951    4.623883     2  5998
6002  6001  O    -20.984056   13.351209   -5.514715     1  6002  6003
6003  6002  H    -21.630437   12.696646   -5.250195     2  6001
6004  6003  H    -20.485393   12.927427   -6.213268     2  6001
6005  6004  O    -23.800988   10.463986   -3.333354     1  6005  6006
6006  6005  H    -23.632171    9.636028   -3.783040     2  6004
6007  6006  H    -24.583816   10.296768   -2.808519     2  6004
6008  6007  O     -9.096055   17.581630   -3.741576     1  6008  6009
6009  6008  H     -9.287616   17.459053   -4.671366     2  6007
6010  6009  H     -9.661484   16.951512   -3.294950     2  6007
6011  6010  O     -8.245733   18.499994  -24.332085     1  6011  6012
6012  6011  H     -8.804968   17.743446  -24.508502     2  6010
6013  6012  H     -7.357737   18.187758  -24.505877     2  6010
6014  6013  O     -8.750213    4.706469  -18.377211     1  6014  6015
6015  6014  H     -9.367213    4.385951  -19.035094     2  6013
6016  6015  H     -8.656129    5.639178  -18.570686     2  6013
6017  6016  O     -7.340033   15.511419  -19.426373     1  6017  6018
6018  6017  H     -6.621743   15.400067  -18.803563     2  6016
6019  6018  H     -7.891171   16.190918  -19.038095     2  6016
6020  6019  O     -4.572891   16.753110  -26.255852     1  6020  6021
6021  6020  H     -4.895429   17.623659  -26.022733     2  6019
6022  6021  H     -4.525953   16.283608  -25.423027     2  6019
6023  6022  O     -5.978348    4.211735  -17.261794     1  6023  6024
6024  6023  H     -6.648679    4.867646  -17.453284     2  6022
6025  6024  H     -5.443820    4.176204  -18.055046     2  6022
6026  6025  O    -33.913937    5.260764  -12.070412     1  6026  6027
6027  6026  H    -34.018431    5.809981  -11.293447     2  6025
6028  6027  H    -32.988844    5.014944  -12.067889     2  6025
6029  6028  O     -6.166829   19.366402  -20.319685     1  6029  6030
6030  6029  H     -6.621327   19.930369  -19.693901     2  6028
6031  6030  H     -5.417099   19.023559  -19.833276     2  6028
6032  6031  O    -11.977109    4.861797  -28.185101     1  6032  6033
6033  6032  H    -11.281369    4.274495  -28.480489     2  6031
6034  6033  H    -11.517928    5.647036  -27.887136     2  6031
6035  6034  O    -20.468044   19.121313    1.574180     1  6035  6036
6036  6035  H    -20.791428   19.034795    2.470935     2  6034
6037  6036  H    -20.768830   19.985401    1.292915     2  6034
6038  6037  O     -0.219197  -34.540790   -6.074259     1  6038  6039
6039  6038  H      0.276741  -34.533109   -5.255590     2  6037
6040  6039  H     -0.884109  -33.862036   -5.958429     2  6037
6041  6040  O    -10.619156    9.884512  -27.891344     1  6041  6042
6042  6041  H    -10.810403   10.289780  -28.737165     2  6040
6043  6042  H    -11.197958    9.123063  -27.853725     2  6040
6044  6043  O    -17.987329    3.908823   -4.479319     1  6044  6045
6045  6044  H    -18.571259    4.660974   -4.381719     2  6043
6046  6045  H    -17.879416    3.571782   -3.589943     2  6043
6047  6046  O    -16.740832   14.874533   -5.388900     1  6047  6048
6048  6047  H    -16.959239   15.624085   -4.835093     2  6046
6049  6048  H    -17.250265   15.009951   -6.187882     2  6046
6050  6049  O    -17.800085    3.020382   -1.824525     1  6050  6051
6051  6050  H    -18.080445    3.642479   -1.153239     2  6049
6052  6051  H    -16.853190    2.948272   -1.704435     2  6049
6053  6052  O     -3.276641   16.784531  -21.823570     1  6053  6054
6054  6053  H     -2.665991   17.501511  -21.994679     2  6052
6055  6054  H     -3.065774   16.496502  -20.935422     2  6052
6056  6055  O    -14.721975   33.159960   -2.855307     1  6056  6057
6057  6056  H    -14.137512   33.917668   -2.877980     2  6055
6058  6057  H    -15.491479   33.435441   -3.353509     2  6055
6059  6058  O    -16.150772    5.664497  -16.163440     1  6059  6060
6060  6059  H    -15.672545    4.926620  -16.541687     2  6058
6061  6060  H    -16.149409    6.329583  -16.851837     2  6058
6062  6061  O     -0.599383    9.893904   -9.819276     1  6062  6063
6063  6062  H     -0.791572   10.419044   -9.042409     2  6061
6064  6063  H     -0.733008    8.989241   -9.536503     2  6061
6065  6064  O    -12.626442   22.163342  -13.367730     1  6065  6066
6066  6065  H    -11.929974   21.508385  -13.320888     2  6064
6067  6066  H    -13.335623   21.726232  -13.839143     2  6064
6068  6067  O     -3.115897   12.775896  -15.481962     1  6068  6069
6069  6068  H     -3.373926   12.138372  -16.147708     2  6067
6070  6069  H     -2.370116   12.371481  -15.038689     2  6067
6071  6070  O    -12.395936   11.019706    4.575570     1  6071  6072
6072  6071  H    -11.706061   10.874651    3.928065     2  6070
6073  6072  H    -12.413153   10.214236    5.092439     2  6070
6074  6073  O    -14.922527   10.862403    3.704833     1  6074  6075
6075  6074  H    -14.009386   11.066098    3.907105     2  6073
6076  6075  H    -15.099891   10.053334    4.184605     2  6073
6077  6076  O     -5.013735   21.394636   -4.795115     1  6077  6078
6078  6077  H     -5.407950   22.237613   -4.571026     2  6076
6079  6078  H     -4.184429   21.621759   -5.215707     2  6076
6080  6079  O    -10.688459   13.358631  -18.999210     1  6080  6081
6081  6080  H    -10.693006   12.405933  -18.906591     2  6079
6082  6081  H     -9.955641   13.539015  -19.587999     2  6079
6083  6082  O    -32.223304    8.709219   -0.837037     1  6083  6084
6084  6083  H    -32.994062    8.311763   -1.242244     2  6082
6085  6084  H    -32.451412    8.784935    0.089497     2  6082
6086  6085  O    -20.896844    0.455324    4.986367     1  6086  6087
6087  6086  H    -21.097620   -0.456241    5.198425     2  6085
6088  6087  H    -20.985378    0.505412    4.034587     2  6085
6089  6088  O    -14.733759    0.342633    1.500741     1  6089  6090
6090  6089  H    -14.295762    0.470174    2.342241     2  6088
6091  6090  H    -15.553899    0.829654    1.580822     2  6088
6092  6091  O     -4.375719    7.228180   33.315577     1  6092  6093
6093  6092  H     -4.280410    6.281017   33.215425     2  6091
6094  6093  H     -3.679239    7.598154   32.773114     2  6091
6095  6094  O    -19.314219   11.863602  -13.673296     1  6095  6096
6096  6095  H    -19.496248   12.113828  -14.579102     2  6094
6097  6096  H    -18.389352   11.616916  -13.673697     2  6094
6098  6097  O     -8.356286    7.196669  -20.030246     1  6098  6099
6099  6098  H     -8.509573    6.542002  -20.711528     2  6097
6100  6099  H     -9.223899    7.554181  -19.841399     2  6097
6101  6100  O     -2.902379   15.664549  -28.233252     1  6101  6102
6102  6101  H     -3.420361   15.795745  -27.439077     2  6100
6103  6102  H     -2.315981   14.938640  -28.020121     2  6100
6104  6103  O     -5.202319   16.666637   -4.854608     1  6104  6105
6105  6104  H     -4.479578   16.060502   -5.017323     2  6103
6106  6105  H     -5.720163   16.244193   -4.169326     2  6103
6107  6106  O     -0.069808   34.491370  -15.214800     1  6107  6108
6108  6107  H      0.332942   35.288578  -14.870584     2  6106
6109  6108  H     -0.994345   34.568574  -14.979209     2  6106
6110  6109  O    -18.261014    3.008651  -32.942053     1  6110  6111
6111  6110  H    -18.676414    3.795641  -32.589458     2  6109
6112  6111  H    -18.414900    2.337592  -32.277051     2  6109
6113  6112  O     34.199947  -12.314858    4.861820     1  6113  6114
6114  6113  H     34.809403  -11.581647    4.946656     2  6112
6115  6114  H     33.602550  -12.050638    4.162150     2  6112
6116  6115  O     -9.116828    2.428453  -16.767913     1  6116  6117
6117  6116  H     -9.053748    3.114648  -17.432283     2  6115
6118  6117  H     -9.890502    1.923130  -17.017529     2  6115
6119  6118  O     -5.192578    7.432066  -14.425394     1  6119  6120
6120  6119  H     -5.322422    8.252757  -14.900618     2  6118
6121  6120  H     -5.845732    7.453807  -13.726004     2  6118
6122  6121  O      0.199054   27.788394  -12.095393     1  6122  6123
6123  6122  H     -0.497927   28.442993  -12.051231     2  6121
6124  6123  H      0.840678   28.076843  -11.446280     2  6121
6125  6124  O     -6.819121   16.690061   -8.472809     1  6125  6126
6126  6125  H     -7.058276   15.919819   -7.957286     2  6124
6127  6126  H     -6.222546   17.181172   -7.907885     2  6124
6128  6127  O    -20.285918    3.952279  -28.579458     1  6128  6129
6129  6128  H    -20.523627    3.766528  -29.487877     2  6127
6130  6129  H    -19.603147    3.313453  -28.374622     2  6127
6131  6130  O     -4.242777   12.903752   -6.532585     1  6131  6132
6132  6131  H     -4.230029   12.292629   -7.269197     2  6130
6133  6132  H     -5.164851   12.957601   -6.281362     2  6130
6134  6133  O     16.859935  -29.904443    1.145990     1  6134  6135
6135  6134  H     17.454794  -29.419246    0.574188     2  6133
6136  6135  H     16.550527  -30.632949    0.607680     2  6133
6137  6136  O    -17.511263    1.922155  -11.663716     1  6137  6138
6138  6137  H    -17.417657    1.923066  -10.711104     2  6136
6139  6138  H    -16.622382    2.056814  -11.992331     2  6136
6140  6139  O      2.190685    6.116163  -25.905743     1  6140  6141
6141  6140  H      1.266323    6.306020  -25.745304     2  6139
6142  6141  H      2.628443    6.344598  -25.085732     2  6139
6143  6142  O     -8.558260    6.987690  -13.493680     1  6143  6144
6144  6143  H     -8.474750    6.146805  -13.943313     2  6142
6145  6144  H     -8.200971    6.829150  -12.619929     2  6142
6146  6145  O    -24.590120    2.234891  -17.418068     1  6146  6147
6147  6146  H    -24.350228    2.762977  -16.656616     2  6145
6148  6147  H    -24.969402    2.861189  -18.034612     2  6145
6149  6148  O    -20.286365   16.932772   -1.913325     1  6149  6150
6150  6149  H    -19.770270   16.383139   -2.503055     2  6148
6151  6150  H    -19.929435   17.812996   -2.031811     2  6148
6152  6151  O     -4.914649   14.813304  -17.779474     1  6152  6153
6153  6152  H     -4.500824   15.411310  -17.157084     2  6151
6154  6153  H     -5.212318   14.077850  -17.243999     2  6151
6155  6154  O    -10.537144    3.057797  -31.486905     1  6155  6156
6156  6155  H    -10.444939    2.936178  -32.431860     2  6154
6157  6156  H    -10.528477    4.007182  -31.365151     2  6154
6158  6157  O    -22.446493   -0.937545   -4.751874     1  6158  6159
6159  6158  H    -22.529050   -0.332488   -4.014770     2  6157
6160  6159  H    -23.309978   -0.931855   -5.164903     2  6157
6161  6160  O     -2.220881   23.428348   -9.775058     1  6161  6162
6162  6161  H     -3.085163   23.021402   -9.714699     2  6160
6163  6162  H     -1.898521   23.179708  -10.641369     2  6160
6164  6163  O     -3.508660    7.616642   -9.963894     1  6164  6165
6165  6164  H     -3.820679    6.854507  -10.451775     2  6163
6166  6165  H     -4.303439    8.019886   -9.614678     2  6163
6167  6166  O    -14.297471    3.578693  -30.945402     1  6167  6168
6168  6167  H    -14.182362    3.390809  -30.013908     2  6166
6169  6168  H    -13.727941    2.950240  -31.389152     2  6166
6170  6169  O     -4.524490    9.863032  -34.783701     1  6170  6171
6171  6170  H     -3.667037   10.288110  -34.801424     2  6169
6172  6171  H     -5.090756   10.443682  -35.292053     2  6169
6173  6172  O     -9.774157    1.232469   -2.314992     1  6173  6174
6174  6173  H    -10.371411    1.963960   -2.158661     2  6172
6175  6174  H     -9.713553    0.787281   -1.469789     2  6172
6176  6175  O    -14.393297    9.909904  -13.543877     1  6176  6177
6177  6176  H    -13.531519   10.049308  -13.151274     2  6175
6178  6177  H    -14.216349    9.799011  -14.478020     2  6175
6179  6178  O     -8.149802   19.485029   -7.967808     1  6179  6180
6180  6179  H     -8.402465   18.609164   -8.259789     2  6178
6181  6180  H     -7.389328   19.340250   -7.404825     2  6178
6182  6181  O    -15.582362   11.127510  -21.239293     1  6182  6183
6183  6182  H    -14.925863   10.452099  -21.068819     2  6181
6184  6183  H    -15.327818   11.502206  -22.082526     2  6181
6185  6184  O     35.850172   12.621591   -1.529069     1  6185  6186
6186  6185  H     36.490499   13.323682   -1.413824     2  6184
6187  6186  H     35.361866   12.604643   -0.705964     2  6184
6188  6187  O    -24.027143    8.366231  -21.508885     1  6188  6189
6189  6188  H    -24.580769    9.057369  -21.872282     2  6187
6190  6189  H    -24.465888    8.108733  -20.698065     2  6187
6191  6190  O     -4.549058   24.780754  -19.588041     1  6191  6192
6192  6191  H     -5.391665   25.222879  -19.691821     2  6190
6193  6192  H     -4.003314   25.411504  -19.118415     2  6190
6194  6193  O    -12.085409    9.429696  -11.920457     1  6194  6195
6195  6194  H    -11.408993    9.802215  -11.354841     2  6193
6196  6195  H    -11.605652    9.086512  -12.674307     2  6193
6197  6196  O     -7.061713   11.970078    0.590777     1  6197  6198
6198  6197  H     -6.397513   11.304714    0.770668     2  6196
6199  6198  H     -7.871989   11.601652    0.942838     2  6196
6200  6199  O     32.353157    3.754629   -5.135719     1  6200  6201
6201  6200  H     33.123632    3.899192   -5.684992     2  6199
6202  6201  H     31.943586    2.969309   -5.498701     2  6199
6203  6202  O    -12.192487    0.247454  -25.868269     1  6203  6204
6204  6203  H    -11.548433   -0.144393  -25.278455     2  6202
6205  6204  H    -12.007372    1.186039  -25.836324     2  6202
6206  6205  O     -9.689289   11.086195  -21.584877     1  6206  6207
6207  6206  H     -9.826176   11.733314  -22.276780     2  6205
6208  6207  H     -8.898178   10.616381  -21.848790     2  6205
6209  6208  O     31.662815  -11.043663   10.024511     1  6209  6210
6210  6209  H     31.989572  -11.535189    9.270944     2  6208
6211  6210  H     31.638189  -11.683498   10.736014     2  6208
6212  6211  O     -2.100061    1.916130    2.181045     1  6212  6213
6213  6212  H     -1.389315    1.349720    2.481463     2  6211
6214  6213  H     -1.970417    1.982601    1.234998     2  6211
6215  6214  O     -4.511319   -0.902719  -30.612020     1  6215  6216
6216  6215  H     -5.428684   -0.708802  -30.804557     2  6214
6217  6216  H     -4.390125   -0.615441  -29.707026     2  6214
6218  6217  O     -7.831596   10.459470  -27.176677     1  6218  6219
6219  6218  H     -7.315064   10.128773  -27.911569     2  6217
6220  6219  H     -8.741227   10.339692  -27.449544     2  6217
6221  6220  O     -9.236466    2.102352  -13.605855     1  6221  6222
6222  6221  H     -8.398182    2.091382  -13.143912     2  6220
6223  6222  H     -9.847527    2.498799  -12.984836     2  6220
6224  6223  O     -4.006207    5.410654  -11.536365     1  6224  6225
6225  6224  H     -3.209427    5.093216  -11.961343     2  6223
6226  6225  H     -4.112423    4.844374  -10.771985     2  6223
6227  6226  O     -3.556351    6.607577  -26.670561     1  6227  6228
6228  6227  H     -4.305499    6.843592  -27.217650     2  6226
6229  6228  H     -2.791958    6.811701  -27.209325     2  6226
6230  6229  O    -13.255999    3.967099  -13.565426     1  6230  6231
6231  6230  H    -13.523114    4.831036  -13.879263     2  6229
6232  6231  H    -12.313664    3.932803  -13.729928     2  6229
6233  6232  O    -13.683850    6.511944  -14.277324     1  6233  6234
6234  6233  H    -13.979346    6.997633  -15.047403     2  6232
6235  6234  H    -13.272220    7.172624  -13.720283     2  6232
6236  6235  O    -13.864917   12.567135  -23.698712     1  6236  6237
6237  6236  H    -13.824055   13.235703  -23.014914     2  6235
6238  6237  H    -13.282567   11.872772  -23.390555     2  6235
6239  6238  O    -11.167225    4.022980  -15.924728     1  6239  6240
6240  6239  H    -10.313755    3.607586  -15.801165     2  6238
6241  6240  H    -11.762272    3.297310  -16.113286     2  6238
6242  6241  O     -3.035476    8.705839  -24.327040     1  6242  6243
6243  6242  H     -2.741624    8.482288  -23.443917     2  6241
6244  6243  H     -3.990952    8.704238  -24.269636     2  6241
6245  6244  O     -5.298573   12.664604   36.246628     1  6245  6246
6246  6245  H     -6.043536   13.228851   36.453719     2  6244
6247  6246  H     -4.681814   12.808343   36.964388     2  6244
6248  6247  O     -1.084049   20.365309   -7.371472     1  6248  6249
6249  6248  H     -1.444864   20.566066   -6.507909     2  6247
6250  6249  H     -0.810660   21.213654   -7.720472     2  6247
6251  6250  O     -0.012292   12.844102  -21.833872     1  6251  6252
6252  6251  H     -0.219382   13.132498  -22.722789     2  6250
6253  6252  H      0.092154   13.655301  -21.336601     2  6250
6254  6253  O     -6.919437    4.482531   -4.667709     1  6254  6255
6255  6254  H     -7.577962    4.984165   -4.187148     2  6253
6256  6255  H     -7.104469    3.569802   -4.446527     2  6253
6257  6256  O    -10.435043   13.085873  -12.676102     1  6257  6258
6258  6257  H    -11.138536   13.734968  -12.678344     2  6256
6259  6258  H    -10.771423   12.365558  -13.209230     2  6256
6260  6259  O     -1.185910   19.950341  -23.816118     1  6260  6261
6261  6260  H     -1.963817   20.494452  -23.938734     2  6259
6262  6261  H     -1.165813   19.383185  -24.586936     2  6259
6263  6262  O    -10.437491   13.466680   -0.346704     1  6263  6264
6264  6263  H    -11.275927   13.074725   -0.590894     2  6262
6265  6264  H     -9.868343   12.719748   -0.161248     2  6262
6266  6265  O      1.302231    3.794394  -24.090290     1  6266  6267
6267  6266  H      1.525436    4.571878  -23.578500     2  6265
6268  6267  H      2.129536    3.523359  -24.488207     2  6265
6269  6268  O     -0.825456   20.977509    3.291182     1  6269  6270
6270  6269  H     -0.493374   20.108222    3.066924     2  6268
6271  6270  H     -0.925517   20.958009    4.242938     2  6268
6272  6271  O     -9.698106   13.349537   -4.206376     1  6272  6273
6273  6272  H    -10.123616   14.094883   -3.782546     2  6271
6274  6273  H    -10.335690   13.044367   -4.851814     2  6271
6275  6274  O    -13.733937   -4.732441  -21.099129     1  6275  6276
6276  6275  H    -13.974124   -3.956876  -21.606121     2  6274
6277  6276  H    -12.778308   -4.762605  -21.144905     2  6274
6278  6277  O     23.059720    0.758111   25.891230     1  6278  6279
6279  6278  H     23.387635    0.446467   25.047678     2  6277
6280  6279  H     22.768481    1.653611   25.719500     2  6277
6281  6280  O    -17.207908   14.338541   -8.613899     1  6281  6282
6282  6281  H    -17.870287   14.871148   -8.173655     2  6280
6283  6282  H    -16.449602   14.917059   -8.694653     2  6280
6284  6283  O     -7.096434    5.400305  -28.547131     1  6284  6285
6285  6284  H     -6.905565    5.173833  -27.636905     2  6283
6286  6285  H     -6.381096    5.007384  -29.047268     2  6283
6287  6286  O    -15.454076   11.986953   -8.465362     1  6287  6288
6288  6287  H    -15.810727   12.865743   -8.594821     2  6286
6289  6288  H    -15.135920   11.987667   -7.562584     2  6286
6290  6289  O     32.014844    3.243860   19.087857     1  6290  6291
6291  6290  H     32.721671    2.941052   19.657887     2  6289
6292  6291  H     32.368357    3.160510   18.202242     2  6289
6293  6292  O      2.742126   18.592333   -8.313374     1  6293  6294
6294  6293  H      2.231619   17.785803   -8.384947     2  6292
6295  6294  H      2.496720   18.957030   -7.463077     2  6292
6296  6295  O     -6.956851   16.600271  -27.988298     1  6296  6297
6297  6296  H     -7.250480   17.475299  -28.241952     2  6295
6298  6297  H     -6.059443   16.728029  -27.680779     2  6295
6299  6298  O    -14.784905   20.099136  -13.938480     1  6299  6300
6300  6299  H    -13.954472   19.640127  -13.812288     2  6298
6301  6300  H    -15.396801   19.653659  -13.352506     2  6298
6302  6301  O    -33.733754    4.665712   -8.112939     1  6302  6303
6303  6302  H    -33.092169    4.221343   -8.667138     2  6301
6304  6303  H    -34.117439    5.335150   -8.679394     2  6301
6305  6304  O    -18.005425    8.290664  -10.142521     1  6305  6306
6306  6305  H    -17.200777    8.805065  -10.077989     2  6304
6307  6306  H    -18.649642    8.897543  -10.507097     2  6304
6308  6307  O     -9.014855   33.406973   -7.179803     1  6308  6309
6309  6308  H     -8.108407   33.368199   -6.874712     2  6307
6310  6309  H     -9.481240   32.780211   -6.626733     2  6307
6311  6310  O     -7.683946    7.082509    2.747716     1  6311  6312
6312  6311  H     -7.886758    6.629891    3.566396     2  6310
6313  6312  H     -6.754849    6.906102    2.599759     2  6310
6314  6313  O     -4.170899   14.684300  -10.229702     1  6314  6315
6315  6314  H     -4.730367   13.977755   -9.907179     2  6313
6316  6315  H     -4.006692   15.230353   -9.460876     2  6313
6317  6316  O     27.992749  -17.671578    7.700349     1  6317  6318
6318  6317  H     27.496896  -18.361906    8.140586     2  6316
6319  6318  H     27.344500  -17.215330    7.163840     2  6316
6320  6319  O     28.666274   -8.428741   14.863011     1  6320  6321
6321  6320  H     28.330436   -9.102398   14.271716     2  6319
6322  6321  H     29.440487   -8.083501   14.418448     2  6319
6323  6322  O    -12.319278   24.264709   -8.405101     1  6323  6324
6324  6323  H    -12.973869   24.444135   -9.080045     2  6322
6325  6324  H    -11.926706   23.431889   -8.666883     2  6322
6326  6325  O     -1.291346   24.858958  -12.521489     1  6326  6327
6327  6326  H     -0.573014   25.469354  -12.687764     2  6325
6328  6327  H     -1.935522   25.373253  -12.034901     2  6325
6329  6328  O    -15.761185    3.697119  -34.182747     1  6329  6330
6330  6329  H    -16.409062    3.179780  -33.704367     2  6328
6331  6330  H    -16.028044    3.627749  -35.099374     2  6328
6332  6331  O     -9.804083    2.741762  -28.520601     1  6332  6333
6333  6332  H    -10.547317    2.450827  -29.048987     2  6331
6334  6333  H     -9.044729    2.317984  -28.920632     2  6331
6335  6334  O      1.093336   14.150478  -24.436409     1  6335  6336
6336  6335  H      0.945236   13.502813  -25.125488     2  6334
6337  6336  H      1.803926   13.783267  -23.910624     2  6334
6338  6337  O     -6.613660   13.141922   -9.460747     1  6338  6339
6339  6338  H     -7.182292   13.391723  -10.189093     2  6337
6340  6339  H     -6.757687   13.819762   -8.800429     2  6337
6341  6340  O     -7.942069   10.763072  -11.981262     1  6341  6342
6342  6341  H     -8.318982   10.029834  -12.467605     2  6340
6343  6342  H     -8.468201   10.817670  -11.183493     2  6340
6344  6343  O    -16.019024    1.706001  -22.482202     1  6344  6345
6345  6344  H    -15.742149    0.789805  -22.469715     2  6343
6346  6345  H    -15.701828    2.041156  -23.320826     2  6343
6347  6346  O    -12.486488   31.227156   -9.454968     1  6347  6348
6348  6347  H    -12.092169   30.364316   -9.327485     2  6346
6349  6348  H    -13.427651   31.076206   -9.367459     2  6346
6350  6349  O    -12.886040    9.805355  -21.406081     1  6350  6351
6351  6350  H    -12.089608    9.995180  -21.901958     2  6349
6352  6351  H    -12.580371    9.328583  -20.634403     2  6349
6353  6352  O     -8.268279    9.334942  -17.165668     1  6353  6354
6354  6353  H     -8.664692    8.515959  -16.868421     2  6352
6355  6354  H     -8.945658    9.749308  -17.700168     2  6352
6356  6355  O     30.797838  -14.054083    7.628411     1  6356  6357
6357  6356  H     30.915313  -14.750659    8.274331     2  6355
6358  6357  H     29.849536  -13.988598    7.515860     2  6355
6359  6358  O    -12.160470   31.009195    0.004206     1  6359  6360
6360  6359  H    -11.284532   31.197649    0.341029     2  6358
6361  6360  H    -12.459072   30.259095    0.518421     2  6358
6362  6361  O    -11.966080   19.680193  -14.735482     1  6362  6363
6363  6362  H    -11.047358   19.524042  -14.954112     2  6361
6364  6363  H    -12.455203   19.129617  -15.346919     2  6361
6365  6364  O     -5.373815   18.828043  -23.839090     1  6365  6366
6366  6365  H     -5.204183   19.617224  -23.324649     2  6364
6367  6366  H     -4.978202   18.120296  -23.330350     2  6364
6368  6367  O    -24.716622    6.023027  -19.781518     1  6368  6369
6369  6368  H    -24.689157    5.633714  -18.907497     2  6367
6370  6369  H    -23.881120    5.778538  -20.179502     2  6367
6371  6370  O    -34.627523   -0.434958   -7.490699     1  6371  6372
6372  6371  H    -34.603725    0.436330   -7.095068     2  6370
6373  6372  H    -35.530353   -0.537220   -7.791815     2  6370
6374  6373  O    -19.080137    3.921533    0.517778     1  6374  6375
6375  6374  H    -19.578382    4.730978    0.404720     2  6373
6376  6375  H    -19.601040    3.402717    1.130739     2  6373
6377  6376  O    -14.818214    4.085531    0.680765     1  6377  6378
6378  6377  H    -13.895966    4.199727    0.910220     2  6376
6379  6378  H    -14.801504    3.627778   -0.159719     2  6376
6380  6379  O     -6.590060   19.224222  -13.016309     1  6380  6381
6381  6380  H     -6.451801   18.478976  -12.431738     2  6379
6382  6381  H     -6.742702   19.964662  -12.429214     2  6379
6383  6382  O    -18.588260    9.784939   -6.803074     1  6383  6384
6384  6383  H    -18.142826    9.079157   -6.334360     2  6382
6385  6384  H    -18.763467    9.422978   -7.671704     2  6382
6386  6385  O     -7.294867   -1.462293   34.439140     1  6386  6387
6387  6386  H     -7.268125   -1.283282   35.379072     2  6385
6388  6387  H     -6.951006   -0.666455   34.033391     2  6385
6389  6388  O    -11.694548   10.455769  -23.861798     1  6389  6390
6390  6389  H    -11.352254   11.017087  -24.557491     2  6388
6391  6390  H    -11.052639    9.749838  -23.785347     2  6388
6392  6391  O     -6.013052   16.545808   -0.024390     1  6392  6393
6393  6392  H     -6.448716   17.390461    0.089581     2  6391
6394  6393  H     -6.628869   16.025892   -0.540808     2  6391
6395  6394  O    -34.748488   -5.730390    5.359350     1  6395  6396
6396  6395  H    -35.284490   -6.273977    4.781902     2  6394
6397  6396  H    -34.239951   -6.356593    5.874608     2  6394
6398  6397  O    -11.343964   12.024503  -15.426573     1  6398  6399
6399  6398  H    -12.187574   12.416949  -15.651382     2  6397
6400  6399  H    -11.195565   11.368185  -16.107348     2  6397
6401  6400  O     -7.458761    1.034774   -8.564701     1  6401  6402
6402  6401  H     -6.515158    1.133387   -8.691669     2  6400
6403  6402  H     -7.563915    0.144911   -8.228076     2  6400
6404  6403  O     -6.023119   10.818686  -18.833939     1  6404  6405
6405  6404  H     -6.436111   10.918086  -17.976158     2  6403
6406  6405  H     -6.224981   11.633788  -19.293386     2  6403
6407  6406  O    -15.443008   14.099906  -14.009451     1  6407  6408
6408  6407  H    -15.037901   13.609385  -14.724649     2  6406
6409  6408  H    -16.145292   14.598016  -14.427681     2  6406
6410  6409  O     -8.721231   27.807052  -10.529835     1  6410  6411
6411  6410  H     -9.062741   27.145360  -11.131306     2  6409
6412  6411  H     -7.901478   28.095741  -10.930953     2  6409
6413  6412  O     28.675421  -17.501599    2.902826     1  6413  6414
6414  6413  H     28.981928  -17.524064    3.809347     2  6412
6415  6414  H     28.367326  -16.604280    2.775831     2  6412
6416  6415  O    -15.967308   10.039627  -10.412122     1  6416  6417
6417  6416  H    -15.626802   10.555709   -9.681405     2  6415
6418  6417  H    -15.909747   10.625358  -11.166998     2  6415
6419  6418  O     -7.840609   18.611586    0.184380     1  6419  6420
6420  6419  H     -7.921761   19.556969    0.058298     2  6418
6421  6420  H     -8.691324   18.341711    0.530331     2  6418
6422  6421  O     -5.114888    5.232854  -22.923406     1  6422  6423
6423  6422  H     -4.597238    4.900778  -23.656886     2  6421
6424  6423  H     -5.727848    4.525610  -22.722614     2  6421
6425  6424  O     -8.504823    6.249223  -35.191691     1  6425  6426
6426  6425  H     -9.363430    5.983438  -35.520910     2  6424
6427  6426  H     -8.552035    6.096941  -34.247862     2  6424
6428  6427  O     19.674171   -8.677151   18.666495     1  6428  6429
6429  6428  H     19.238955   -9.022775   19.445829     2  6427
6430  6429  H     20.576284   -8.519920   18.945246     2  6427
6431  6430  O    -24.230108    5.130677  -17.221820     1  6431  6432
6432  6431  H    -23.964360    6.031244  -17.035840     2  6430
6433  6432  H    -24.105284    4.667683  -16.393395     2  6430
6434  6433  O     -9.632748   27.745951   -6.456810     1  6434  6435
6435  6434  H     -8.786696   27.465987   -6.806163     2  6433
6436  6435  H    -10.077101   26.931179   -6.222441     2  6433
6437  6436  O     -5.666228    7.974849  -23.999267     1  6437  6438
6438  6437  H     -5.878610    8.506565  -23.232193     2  6436
6439  6438  H     -5.440653    7.116300  -23.641158     2  6436
6440  6439  O     -6.392063    3.535623   -7.392699     1  6440  6441
6441  6440  H     -7.312562    3.275077   -7.424782     2  6439
6442  6441  H     -5.981005    2.893745   -6.813686     2  6439
6443  6442  O    -14.933874    1.923648  -12.416261     1  6443  6444
6444  6443  H    -14.110733    1.740735  -11.963258     2  6442
6445  6444  H    -14.735170    2.668499  -12.983663     2  6442
6446  6445  O    -27.488025    3.758287  -15.164215     1  6446  6447
6447  6446  H    -27.787926    4.467025  -15.733407     2  6445
6448  6447  H    -28.103065    3.762945  -14.430773     2  6445
6449  6448  O     25.525843  -19.565738    7.056322     1  6449  6450
6450  6449  H     25.799796  -20.007854    7.859886     2  6448
6451  6450  H     24.627920  -19.284168    7.231491     2  6448
6452  6451  O    -14.812644    5.852418  -32.416410     1  6452  6453
6453  6452  H    -13.934939    6.234327  -32.419705     2  6451
6454  6453  H    -14.673782    4.933778  -32.186084     2  6451
6455  6454  O     28.717499    8.225830    0.529873     1  6455  6456
6456  6455  H     29.491106    7.745176    0.235364     2  6454
6457  6456  H     28.010188    7.581428    0.503622     2  6454
6458  6457  O     -1.367475   10.991070  -30.845067     1  6458  6459
6459  6458  H     -2.302257   11.193314  -30.806181     2  6457
6460  6459  H     -1.322290   10.152348  -31.304126     2  6457
6461  6460  O    -18.745090    6.471275  -28.274437     1  6461  6462
6462  6461  H    -17.930214    6.078734  -27.961196     2  6460
6463  6462  H    -19.173427    5.772612  -28.769035     2  6460
6464  6463  O     -1.871272   17.954001  -29.248475     1  6464  6465
6465  6464  H     -1.446827   17.825124  -30.096690     2  6463
6466  6465  H     -1.990841   17.069337  -28.903070     2  6463
6467  6466  O    -15.461810   16.338181   -0.768070     1  6467  6468
6468  6467  H    -15.072144   16.016237    0.044792     2  6466
6469  6468  H    -14.741678   16.331273   -1.398621     2  6466
6470  6469  O     -7.543404   31.434220  -12.181030     1  6470  6471
6471  6470  H     -6.744194   31.959115  -12.136540     2  6469
6472  6471  H     -8.253444   32.075736  -12.157943     2  6469
6473  6472  O     -9.050903   33.891362   -3.588947     1  6473  6474
6474  6473  H     -8.271096   33.452011   -3.928216     2  6472
6475  6474  H     -9.253411   33.427441   -2.776544     2  6472
6476  6475  O     -7.257632   12.449599   32.091639     1  6476  6477
6477  6476  H     -6.781606   12.310151   31.272990     2  6475
6478  6477  H     -7.512180   13.372006   32.067107     2  6475
6479  6478  O     -5.941607    8.476036  -20.028120     1  6479  6480
6480  6479  H     -6.758367    7.976960  -20.035641     2  6478
6481  6480  H     -6.112441    9.206946  -19.434134     2  6478
6482  6481  O     -9.940368   21.599725   -7.609403     1  6482  6483
6483  6482  H     -9.570265   20.753152   -7.859543     2  6481
6484  6483  H    -10.134524   21.510503   -6.676357     2  6481
6485  6484  O     -2.128586    7.317662  -34.769397     1  6485  6486
6486  6485  H     -2.366782    7.557972  -35.664800     2  6484
6487  6486  H     -2.945835    7.008776  -34.378341     2  6484
6488  6487  O     -7.707834   14.403632   -7.154296     1  6488  6489
6489  6488  H     -7.445216   13.721239   -6.536555     2  6487
6490  6489  H     -8.526201   14.748581   -6.797200     2  6487
6491  6490  O     -2.510155   10.204082  -12.025561     1  6491  6492
6492  6491  H     -1.911498    9.921669  -11.334124     2  6490
6493  6492  H     -3.374969   10.187978  -11.615598     2  6490
6494  6493  O     -0.227193   26.900352    0.300277     1  6494  6495
6495  6494  H     -0.084223   26.066572   -0.147607     2  6493
6496  6495  H     -0.657204   27.452790   -0.352512     2  6493
6497  6496  O    -15.838036    0.133527  -35.089819     1  6497  6498
6498  6497  H    -14.884664    0.112165  -35.172625     2  6496
6499  6498  H    -16.152111   -0.448888  -35.781470     2  6496
6500  6499  O     19.086010  -10.604785   16.791010     1  6500  6501
6501  6500  H     19.365316  -11.384207   17.271343     2  6499
6502  6501  H     19.389183   -9.871495   17.326365     2  6499
6503  6502  O    -31.707303    5.057178  -16.448576     1  6503  6504
6504  6503  H    -31.792305    4.225133  -15.983056     2  6502
6505  6504  H    -31.304911    4.824064  -17.285218     2  6502
6506  6505  O     -3.814487   29.916367  -20.637779     1  6506  6507
6507  6506  H     -3.404629   30.517482  -21.259800     2  6505
6508  6507  H     -3.102404   29.343787  -20.352608     2  6505
6509  6508  O    -19.522439   25.095440   -4.289148     1  6509  6510
6510  6509  H    -18.865022   25.716826   -3.976237     2  6508
6511  6510  H    -20.249666   25.643596   -4.583932     2  6508
6512  6511  O    -11.643623   31.524057    3.788929     1  6512  6513
6513  6512  H    -11.031818   32.156738    3.412578     2  6511
6514  6513  H    -11.828807   31.861397    4.665366     2  6511
6515  6514  O     -3.773785   -0.199638   -1.555880     1  6515  6516
6516  6515  H     -2.833110   -0.086754   -1.692334     2  6514
6517  6516  H     -3.838777   -0.865391   -0.871204     2  6514
6518  6517  O     -0.485414   31.888885   -9.013241     1  6518  6519
6519  6518  H     -0.437822   30.944281   -9.160516     2  6517
6520  6519  H      0.428135   32.171131   -8.968548     2  6517
6521  6520  O    -35.088690    0.272099   -1.387291     1  6521  6522
6522  6521  H    -34.190652   -0.047577   -1.474280     2  6520
6523  6522  H    -35.119863    0.665860   -0.515390     2  6520
6524  6523  O     -5.177078   25.778442   -9.187832     1  6524  6525
6525  6524  H     -4.796413   25.887906  -10.059235     2  6523
6526  6525  H     -4.443023   25.907856   -8.587293     2  6523
6527  6526  O    -22.287496   20.809758   -2.117617     1  6527  6528
6528  6527  H    -21.814569   21.589718   -2.407849     2  6526
6529  6528  H    -22.899967   21.132568   -1.456629     2  6526
6530  6529  O    -10.076200    2.122670  -34.260303     1  6530  6531
6531  6530  H     -9.827547    2.320829  -35.163152     2  6529
6532  6531  H     -9.633675    1.296609  -34.065298     2  6529
6533  6532  O     13.008139  -19.098473   20.750250     1  6533  6534
6534  6533  H     13.088613  -20.039998   20.902845     2  6532
6535  6534  H     13.899428  -18.762800   20.845951     2  6532
6536  6535  O    -11.990539   20.395583   -5.301832     1  6536  6537
6537  6536  H    -11.953017   19.717034   -5.975921     2  6535
6538  6537  H    -12.852932   20.796012   -5.412134     2  6535
6539  6538  O    -14.333842   24.743184   -1.421938     1  6539  6540
6540  6539  H    -13.394296   24.903023   -1.511024     2  6538
6541  6540  H    -14.517815   24.040177   -2.044969     2  6538
6542  6541  O    -11.703393   18.529071    0.380632     1  6542  6543
6543  6542  H    -11.178966   17.930209    0.912208     2  6541
6544  6543  H    -11.319286   19.391091    0.540682     2  6541
6545  6544  O    -32.128974   15.650022   -4.116887     1  6545  6546
6546  6545  H    -31.409059   15.245944   -3.632454     2  6544
6547  6546  H    -32.558525   14.919561   -4.562022     2  6544
6548  6547  O     30.846590   -7.325317   13.608034     1  6548  6549
6549  6548  H     30.690052   -6.472937   13.201616     2  6547
6550  6549  H     31.503540   -7.152611   14.282437     2  6547
6551  6550  O      0.452711   32.460347  -12.138128     1  6551  6552
6552  6551  H      0.966870   31.668754  -11.979221     2  6550
6553  6552  H     -0.049563   32.265478  -12.929316     2  6550
6554  6553  O     -6.547216    2.192475  -29.281305     1  6554  6555
6555  6554  H     -6.975604    1.747203  -28.550245     2  6553
6556  6555  H     -5.709949    2.488838  -28.924396     2  6553
6557  6556  O      9.406769  -14.877566   28.959904     1  6557  6558
6558  6557  H      9.864161  -14.675129   28.143790     2  6556
6559  6558  H      9.684923  -15.767475   29.176529     2  6556
6560  6559  O     -2.429744   15.902946  -19.276856     1  6560  6561
6561  6560  H     -2.578425   16.788775  -18.946050     2  6559
6562  6561  H     -3.208401   15.413718  -19.011186     2  6559
6563  6562  O     -3.265807   23.450805   -2.311939     1  6563  6564
6564  6563  H     -2.774488   22.630242   -2.273025     2  6562
6565  6564  H     -3.732457   23.490932   -1.477159     2  6562
6566  6565  O     23.328468   -7.216734    7.491794     1  6566  6567
6567  6566  H     23.045313   -7.538383    6.635876     2  6565
6568  6567  H     24.209415   -7.574197    7.603077     2  6565
6569  6568  O     -1.187577   -2.681772   -1.403249     1  6569  6570
6570  6569  H     -1.188095   -3.244855   -2.177309     2  6568
6571  6570  H     -0.994284   -1.807783   -1.742386     2  6568
6572  6571  O    -16.925979   32.639601   -0.676332     1  6572  6573
6573  6572  H    -17.426977   33.426721   -0.890047     2  6571
6574  6573  H    -16.013135   32.890274   -0.818141     2  6571
6575  6574  O    -14.378335   15.958879    5.542719     1  6575  6576
6576  6575  H    -14.789336   15.853875    4.684650     2  6574
6577  6576  H    -14.059616   15.084054    5.764824     2  6574
6578  6577  O      2.527355   18.075396  -14.435165     1  6578  6579
6579  6578  H      1.634757   17.857103  -14.703213     2  6577
6580  6579  H      2.568818   19.029911  -14.493583     2  6577
6581  6580  O     -1.890129   29.364117  -12.464982     1  6581  6582
6582  6581  H     -2.566678   29.414523  -11.789725     2  6580
6583  6582  H     -2.362157   29.114759  -13.259489     2  6580
6584  6583  O    -15.614151   28.705989   -2.852893     1  6584  6585
6585  6584  H    -15.148205   28.209413   -2.180183     2  6583
6586  6585  H    -15.172358   29.554880   -2.873748     2  6583
6587  6586  O     -5.465958   35.932293   -4.416392     1  6587  6588
6588  6587  H     -4.891437   35.274813   -4.024122     2  6586
6589  6588  H     -5.797677   36.435488   -3.672759     2  6586
6590  6589  O    -22.540117   -0.730305   -0.536390     1  6590  6591
6591  6590  H    -23.127835   -0.437293   -1.232783     2  6589
6592  6591  H    -21.854102   -0.063503   -0.504923     2  6589
6593  6592  O     -2.024625   21.380557    0.273698     1  6593  6594
6594  6593  H     -1.140286   21.691351    0.467563     2  6592
6595  6594  H     -2.024424   20.465548    0.554752     2  6592
6596  6595  O     -3.008993   29.420293   -6.992140     1  6596  6597
6597  6596  H     -3.854811   29.007501   -6.817711     2  6595
6598  6597  H     -3.221127   30.185741   -7.526295     2  6595
6599  6598  O    -19.992481   17.321087  -10.745704     1  6599  6600
6600  6599  H    -19.378208   16.960163  -11.384949     2  6598
6601  6600  H    -20.268360   18.156383  -11.123067     2  6598
6602  6601  O     -1.474200   14.958211  -16.087826     1  6602  6603
6603  6602  H     -2.192082   14.399207  -15.790518     2  6601
6604  6603  H     -0.985443   14.413396  -16.704693     2  6601
6605  6604  O    -22.911482   14.348069  -14.586360     1  6605  6606
6606  6605  H    -23.692110   13.796627  -14.533783     2  6604
6607  6606  H    -22.182435   13.728973  -14.624335     2  6604
6608  6607  O     -2.884977   19.624584  -31.905598     1  6608  6609
6609  6608  H     -3.648154   19.800670  -32.455858     2  6607
6610  6609  H     -2.996239   20.200816  -31.149417     2  6607
6611  6610  O      4.018477  -31.880644   16.225357     1  6611  6612
6612  6611  H      4.932302  -32.114258   16.388387     2  6610
6613  6612  H      3.925799  -31.002321   16.594399     2  6610
6614  6613  O    -18.896285    9.035206  -13.066889     1  6614  6615
6615  6614  H    -17.972460    8.801709  -13.157761     2  6613
6616  6615  H    -18.967692    9.896570  -13.478211     2  6613
6617  6616  O    -16.913814   -3.843944  -30.959934     1  6617  6618
6618  6617  H    -16.071229   -3.609943  -30.570671     2  6616
6619  6618  H    -17.125857   -4.696031  -30.578860     2  6616
6620  6619  O    -19.404819    6.480633  -14.261828     1  6620  6621
6621  6620  H    -19.089541    7.294857  -13.869566     2  6619
6622  6621  H    -19.229560    5.811759  -13.599918     2  6619
6623  6622  O     14.337496  -21.010233   15.588668     1  6623  6624
6624  6623  H     14.504364  -21.705009   16.225593     2  6622
6625  6624  H     13.691367  -21.384062   14.989500     2  6622
6626  6625  O    -28.199814   -0.077851   -4.401788     1  6626  6627
6627  6626  H    -28.060080   -1.022189   -4.472015     2  6625
6628  6627  H    -29.040421    0.073162   -4.834001     2  6625
6629  6628  O     -4.318733   31.567331   -0.069313     1  6629  6630
6630  6629  H     -4.173385   30.635162    0.092446     2  6628
6631  6630  H     -3.817113   31.754280   -0.862823     2  6628
6632  6631  O    -33.107464   -4.203759    9.483218     1  6632  6633
6633  6632  H    -33.574993   -4.935127    9.079796     2  6631
6634  6633  H    -32.537795   -3.871223    8.789584     2  6631
6635  6634  O    -10.986911   22.681974   -2.259341     1  6635  6636
6636  6635  H    -11.866535   22.387331   -2.023378     2  6634
6637  6636  H    -11.072550   23.628931   -2.369662     2  6634
6638  6637  O     -5.072126   21.879432  -22.394550     1  6638  6639
6639  6638  H     -5.663278   21.515435  -21.735552     2  6637
6640  6639  H     -4.490307   22.458012  -21.901637     2  6637
6641  6640  O     20.676765   -2.825665   29.287992     1  6641  6642
6642  6641  H     20.941443   -2.023114   28.838449     2  6640
6643  6642  H     21.487127   -3.326310   29.382328     2  6640
6644  6643  O      3.156067   28.476954  -14.620422     1  6644  6645
6645  6644  H      4.104693   28.581625  -14.693814     2  6643
6646  6645  H      3.028578   27.539436  -14.475380     2  6643
6647  6646  O     -6.776155   26.415677  -19.240970     1  6647  6648
6648  6647  H     -7.025376   26.720610  -18.368539     2  6646
6649  6648  H     -6.929433   27.168944  -19.811344     2  6646
6650  6649  O     -5.280227    9.737609  -16.243107     1  6650  6651
6651  6650  H     -4.655363    9.026616  -16.385466     2  6649
6652  6651  H     -5.983561    9.568059  -16.869849     2  6649
6653  6652  O     -4.048657   34.793199   -9.247905     1  6653  6654
6654  6653  H     -3.342919   34.545046   -9.845053     2  6652
6655  6654  H     -3.616373   34.913787   -8.402434     2  6652
6656  6655  O     -0.086619   25.270272  -18.820120     1  6656  6657
6657  6656  H      0.759451   25.375928  -19.255131     2  6655
6658  6657  H     -0.561026   24.643977  -19.366860     2  6655
6659  6658  O     25.846919  -27.332477   -0.859862     1  6659  6660
6660  6659  H     24.954782  -27.655097   -0.732426     2  6658
6661  6660  H     26.349033  -27.727348   -0.146988     2  6658
6662  6661  O    -24.833867    7.730443   -3.100721     1  6662  6663
6663  6662  H    -23.944246    7.550898   -3.404973     2  6661
6664  6663  H    -24.915075    7.230814   -2.288312     2  6661
6665  6664  O    -26.233095    1.179901    4.312156     1  6665  6666
6666  6665  H    -25.604223    0.819533    3.686946     2  6664
6667  6666  H    -25.795485    1.109168    5.160522     2  6664
6668  6667  O    -21.966865    1.346128  -17.575768     1  6668  6669
6669  6668  H    -22.818529    1.778986  -17.516327     2  6667
6670  6669  H    -21.648937    1.317048  -16.673378     2  6667
6671  6670  O     -8.522414   -0.886531  -21.923222     1  6671  6672
6672  6671  H     -8.397465   -1.824333  -21.777804     2  6670
6673  6672  H     -8.593798   -0.514766  -21.044059     2  6670
6674  6673  O    -17.180706    9.054698  -15.893494     1  6674  6675
6675  6674  H    -17.384706    8.327213  -16.481185     2  6673
6676  6675  H    -16.905760    8.634891  -15.078388     2  6673
6677  6676  O     -0.764168   31.474730  -17.451277     1  6677  6678
6678  6677  H     -0.751893   30.540984  -17.661517     2  6676
6679  6678  H     -0.656123   31.508155  -16.500783     2  6676
6680  6679  O    -28.946995   -0.733173  -23.717817     1  6680  6681
6681  6680  H    -29.224208   -1.649323  -23.725097     2  6679
6682  6681  H    -29.184305   -0.417556  -22.845864     2  6679
6683  6682  O     -7.172617    7.015152   32.192288     1  6683  6684
6684  6683  H     -7.934132    6.839942   32.745125     2  6682
6685  6684  H     -6.420766    6.799731   32.744143     2  6682
6686  6685  O     -1.338207   33.812925   -1.975723     1  6686  6687
6687  6686  H     -1.231914   33.471454   -1.087843     2  6685
6688  6687  H     -0.444299   33.912041   -2.303344     2  6685
6689  6688  O    -28.874458    3.079755    0.008740     1  6689  6690
6690  6689  H    -28.797675    3.612311    0.800396     2  6688
6691  6690  H    -28.464406    3.607704   -0.676359     2  6688
6692  6691  O     -6.502428  -34.709815    0.605180     1  6692  6693
6693  6692  H     -7.075245  -33.944515    0.555894     2  6691
6694  6693  H     -6.333132  -34.823029    1.540462     2  6691
6695  6694  O      5.045612   28.945904  -18.417509     1  6695  6696
6696  6695  H      5.354792   28.269450  -19.020045     2  6694
6697  6696  H      4.972493   29.732945  -18.957373     2  6694
6698  6697  O      0.951073   24.970244   -3.206638     1  6698  6699
6699  6698  H      1.723643   24.468953   -3.467552     2  6697
6700  6699  H      0.765671   25.533751   -3.957848     2  6697
6701  6700  O      0.698005   23.618735   -6.032791     1  6701  6702
6702  6701  H      1.435598   23.135746   -5.660086     2  6700
6703  6702  H      0.966482   23.811075   -6.931210     2  6700
6704  6703  O     25.405062  -10.011965   12.039765     1  6704  6705
6705  6704  H     26.291564   -9.655487   11.982572     2  6703
6706  6705  H     25.524201  -10.897617   12.382777     2  6703
6707  6706  O    -23.328049   22.597569   -0.398071     1  6707  6708
6708  6707  H    -24.285161   22.605860   -0.388141     2  6706
6709  6708  H    -23.084652   23.442265   -0.776856     2  6706
6710  6709  O     22.597680   -8.540985   18.786083     1  6710  6711
6711  6710  H     22.609532   -8.136441   17.918652     2  6709
6712  6711  H     23.448024   -8.974117   18.860525     2  6709
6713  6712  O    -12.588951    1.703768  -16.292134     1  6713  6714
6714  6713  H    -12.908244    0.907823  -15.866981     2  6712
6715  6714  H    -12.840574    1.602956  -17.210151     2  6712
6716  6715  O     -0.773227    8.670918   -4.506370     1  6716  6717
6717  6716  H     -1.020531    8.376316   -5.382887     2  6715
6718  6717  H     -1.025738    7.949234   -3.930486     2  6715
6719  6718  O     -7.285508   27.355255   -3.148845     1  6719  6720
6720  6719  H     -8.203165   27.309768   -3.417298     2  6718
6721  6720  H     -6.799598   27.002760   -3.894412     2  6718
6722  6721  O      0.116206   27.580243  -14.846351     1  6722  6723
6723  6722  H      0.216595   27.571423  -13.894471     2  6721
6724  6723  H      0.035995   28.507333  -15.070630     2  6721
6725  6724  O     -9.586570   21.570148   -4.371905     1  6725  6726
6726  6725  H    -10.399684   21.136947   -4.631546     2  6724
6727  6726  H     -9.847838   22.174284   -3.676929     2  6724
6728  6727  O    -25.325406    0.764089  -10.524305     1  6728  6729
6729  6728  H    -25.923208    1.198402   -9.915834     2  6727
6730  6729  H    -24.878498    0.105434   -9.992629     2  6727
6731  6730  O     11.987853  -10.979824   29.013838     1  6731  6732
6732  6731  H     11.580788  -10.278355   28.505437     2  6730
6733  6732  H     11.676915  -11.786101   28.602175     2  6730
6734  6733  O     -6.191968    2.838119  -22.439098     1  6734  6735
6735  6734  H     -5.897140    1.975072  -22.729713     2  6733
6736  6735  H     -7.143909    2.758575  -22.378168     2  6733
6737  6736  O    -30.911324   20.984984   -1.487842     1  6737  6738
6738  6737  H    -31.518567   21.723327   -1.536205     2  6736
6739  6738  H    -30.324498   21.107613   -2.234052     2  6736
6740  6739  O    -29.599937   19.702641    0.509953     1  6740  6741
6741  6740  H    -29.930274   18.881259    0.146029     2  6739
6742  6741  H    -29.937897   20.378538   -0.077567     2  6739
6743  6742  O     -5.281678   15.825966    2.479859     1  6743  6744
6744  6743  H     -5.627404   16.292744    1.719055     2  6742
6745  6744  H     -4.679670   15.179335    2.111503     2  6742
6746  6745  O     -3.598185   26.645334  -11.739451     1  6746  6747
6747  6746  H     -3.608386   27.478656  -11.268597     2  6745
6748  6747  H     -3.810571   26.877817  -12.643373     2  6745
6749  6748  O     -1.877109   10.269727  -16.453116     1  6749  6750
6750  6749  H     -1.700819    9.575831  -17.088459     2  6748
6751  6750  H     -1.035775   10.712380  -16.341554     2  6748
6752  6751  O     -8.801786   22.919593   -9.837679     1  6752  6753
6753  6752  H     -8.007660   23.149229   -9.355120     2  6751
6754  6753  H     -9.340752   22.448196   -9.202438     2  6751
6755  6754  O     -6.277101   33.804564    0.100935     1  6755  6756
6756  6755  H     -5.705799   33.058677   -0.082086     2  6754
6757  6756  H     -5.820228   34.294758    0.784461     2  6754
6758  6757  O     -6.358317   28.852711  -11.647047     1  6758  6759
6759  6758  H     -6.724917   29.666243  -11.993457     2  6757
6760  6759  H     -6.448517   28.224559  -12.363651     2  6757
6761  6760  O      9.312205  -10.916288   30.222899     1  6761  6762
6762  6761  H      9.252657  -11.008814   29.272045     2  6760
6763  6762  H      9.261311   -9.972761   30.375863     2  6760
6764  6763  O     -4.840518   25.985557  -16.382927     1  6764  6765
6765  6764  H     -4.244023   25.351914  -15.984276     2  6763
6766  6765  H     -4.402337   26.252114  -17.191120     2  6763
6767  6766  O    -11.873998   25.610535    4.401142     1  6767  6768
6768  6767  H    -12.713467   26.044257    4.554142     2  6766
6769  6768  H    -11.906735   25.341365    3.483151     2  6766
6770  6769  O    -10.124781   35.699690   -7.808143     1  6770  6771
6771  6770  H     -9.552977   34.937965   -7.713025     2  6769
6772  6771  H    -11.001665   35.366885   -7.616971     2  6769
6773  6772  O    -27.147173    2.449415   -9.473528     1  6773  6774
6774  6773  H    -26.636866    3.237832   -9.288549     2  6772
6775  6774  H    -27.507892    2.192435   -8.624956     2  6772
6776  6775  O     -6.242921    0.985670   34.102884     1  6776  6777
6777  6776  H     -6.321537    1.793507   34.610279     2  6775
6778  6777  H     -6.076964    1.279971   33.207297     2  6775
6779  6778  O    -24.913354    8.521209   -7.688439     1  6779  6780
6780  6779  H    -25.115165    8.029996   -6.892062     2  6778
6781  6780  H    -24.655494    9.388640   -7.376506     2  6778
6782  6781  O    -16.047378   32.402217    2.821588     1  6782  6783
6783  6782  H    -15.435803   32.692720    2.144967     2  6781
6784  6783  H    -16.912339   32.513170    2.426920     2  6781
6785  6784  O    -14.215044   21.725001   -5.611603     1  6785  6786
6786  6785  H    -14.830095   22.141322   -6.215441     2  6784
6787  6786  H    -13.800960   22.454267   -5.150152     2  6784
6788  6787  O     -9.987259    6.215340  -30.920116     1  6788  6789
6789  6788  H     -9.315625    6.816600  -31.242025     2  6787
6790  6789  H    -10.027675    6.382559  -29.978503     2  6787
6791  6790  O     -3.447013   31.178350    2.684243     1  6791  6792
6792  6791  H     -3.501429   31.543850    1.801248     2  6790
6793  6792  H     -3.221382   31.924726    3.239442     2  6790
6794  6793  O      4.636564    3.954374    6.730566     1  6794  6795
6795  6794  H      4.791525    3.589719    7.601912     2  6793
6796  6795  H      4.549674    3.189146    6.162140     2  6793
6797  6796  O    -29.756959    6.986654   -7.756280     1  6797  6798
6798  6797  H    -29.653056    6.097476   -7.417458     2  6796
6799  6798  H    -28.861951    7.308271   -7.864700     2  6796
6800  6799  O    -11.172082   20.613391  -10.927466     1  6800  6801
6801  6800  H    -10.606838   21.070944  -11.549862     2  6799
6802  6801  H    -11.524457   21.306331  -10.368988     2  6799
6803  6802  O     -8.525462   25.022946  -20.951432     1  6803  6804
6804  6803  H     -8.091349   25.559782  -20.288419     2  6802
6805  6804  H     -8.067862   24.182904  -20.917348     2  6802
6806  6805  O    -13.563949    5.297543  -10.566747     1  6806  6807
6807  6806  H    -13.936327    6.151188  -10.345712     2  6805
6808  6807  H    -13.964632    5.070964  -11.406000     2  6805
6809  6808  O     -8.547343   22.275601  -21.852165     1  6809  6810
6810  6809  H     -8.500327   21.344939  -22.071002     2  6808
6811  6810  H     -8.904103   22.295602  -20.964160     2  6808
6812  6811  O    -10.116993    5.047397   -7.639155     1  6812  6813
6813  6812  H    -11.072520    5.088810   -7.677687     2  6811
6814  6813  H     -9.929551    4.198965   -7.237584     2  6811
6815  6814  O     -9.521733   18.489914  -15.591133     1  6815  6816
6816  6815  H     -9.512345   17.609989  -15.214468     2  6814
6817  6816  H     -8.707417   18.890156  -15.286294     2  6814
6818  6817  O      0.053212   15.789603   -0.694719     1  6818  6819
6819  6818  H     -0.901624   15.814900   -0.632428     2  6817
6820  6819  H      0.357585   16.081539    0.164561     2  6817
6821  6820  O     -6.908402   21.290602  -11.373258     1  6821  6822
6822  6821  H     -6.083706   21.321811  -10.888351     2  6820
6823  6822  H     -7.521816   21.791914  -10.836005     2  6820
6824  6823  O    -27.038010   20.185292    0.970522     1  6824  6825
6825  6824  H    -26.638305   19.507215    0.425840     2  6823
6826  6825  H    -27.956138   19.924527    1.043141     2  6823
6827  6826  O      1.455705    6.607475  -32.068948     1  6827  6828
6828  6827  H      0.813928    6.051684  -31.626850     2  6826
6829  6828  H      1.451263    6.303851  -32.976706     2  6826
6830  6829  O     -3.106781   31.484860   -8.928111     1  6830  6831
6831  6830  H     -3.608378   32.239457   -9.236683     2  6829
6832  6831  H     -2.203919   31.799425   -8.882054     2  6829
6833  6832  O    -10.521257   21.026412    0.403542     1  6833  6834
6834  6833  H    -10.862744   21.500370   -0.354734     2  6832
6835  6834  H     -9.670326   21.429690    0.575341     2  6832
6836  6835  O     -9.694913   18.923746    6.624763     1  6836  6837
6837  6836  H     -9.649147   18.644303    5.710406     2  6835
6838  6837  H    -10.624160   18.866204    6.847070     2  6835
6839  6838  O    -14.251260   10.119908   -3.809405     1  6839  6840
6840  6839  H    -13.394393   10.306299   -3.425649     2  6838
6841  6840  H    -14.194657    9.206783   -4.090885     2  6838
6842  6841  O     -1.079349  -34.531703   -9.905234     1  6842  6843
6843  6842  H     -1.729090  -34.859616  -10.526958     2  6841
6844  6843  H     -0.379883  -35.184918   -9.922215     2  6841
6845  6844  O    -15.957650   22.879110   -7.592807     1  6845  6846
6846  6845  H    -16.180595   22.979870   -8.518212     2  6844
6847  6846  H    -16.511038   23.516769   -7.141825     2  6844
6848  6847  O     -1.856812    4.719632   -5.459182     1  6848  6849
6849  6848  H     -2.077874    5.508350   -4.963917     2  6847
6850  6849  H     -1.008868    4.446269   -5.109189     2  6847
6851  6850  O    -17.414621   19.077092   -1.588075     1  6851  6852
6852  6851  H    -18.207063   19.571313   -1.797867     2  6850
6853  6852  H    -16.754722   19.412864   -2.194723     2  6850
6854  6853  O    -14.925017   15.725047   -8.620386     1  6854  6855
6855  6854  H    -14.650738   16.194350   -9.408268     2  6853
6856  6855  H    -14.147994   15.719847   -8.061423     2  6853
6857  6856  O     -3.043562   18.397985  -18.386545     1  6857  6858
6858  6857  H     -2.501967   18.743576  -19.096103     2  6856
6859  6858  H     -3.480942   19.167381  -18.021908     2  6856
6860  6859  O    -23.884727   12.193679   -5.372632     1  6860  6861
6861  6860  H    -23.755027   11.731650   -4.544417     2  6859
6862  6861  H    -24.360754   12.988505   -5.132045     2  6859
6863  6862  O     11.604792  -30.126569    8.062085     1  6863  6864
6864  6863  H     12.416953  -30.149559    7.556024     2  6862
6865  6864  H     11.890158  -30.014997    8.968920     2  6862
6866  6865  O    -23.484243   24.645987   -4.860629     1  6866  6867
6867  6866  H    -23.841805   23.772863   -5.021984     2  6865
6868  6867  H    -23.708291   25.145894   -5.645566     2  6865
6869  6868  O     -7.649217   19.905695   -3.573886     1  6869  6870
6870  6869  H     -8.262148   19.172331   -3.626071     2  6868
6871  6870  H     -8.095833   20.624082   -4.021866     2  6868
6872  6871  O    -20.528403   -2.334109  -23.107136     1  6872  6873
6873  6872  H    -19.763191   -2.266601  -22.536063     2  6871
6874  6873  H    -20.347221   -3.092360  -23.662529     2  6871
6875  6874  O    -15.555705   27.634900   -9.465474     1  6875  6876
6876  6875  H    -16.483785   27.506024   -9.661154     2  6874
6877  6876  H    -15.204861   26.749212   -9.372216     2  6874
6878  6877  O     29.460447   -9.467471   10.069526     1  6878  6879
6879  6878  H     30.163804  -10.115638   10.106945     2  6877
6880  6879  H     29.900255   -8.628030   10.204206     2  6877
6881  6880  O    -10.259523    9.011295  -33.694537     1  6881  6882
6882  6881  H     -9.875564    9.725511  -34.203165     2  6880
6883  6882  H    -11.200543    9.081062  -33.855299     2  6880
6884  6883  O    -14.000946   14.635900   -5.504287     1  6884  6885
6885  6884  H    -14.027241   13.724019   -5.214439     2  6883
6886  6885  H    -14.920530   14.884649   -5.597671     2  6883
6887  6886  O    -24.122731    6.075525    4.291918     1  6887  6888
6888  6887  H    -23.837461    5.166699    4.197638     2  6886
6889  6888  H    -24.586744    6.095813    5.128884     2  6886
6890  6889  O    -28.965194   15.340418   -5.883716     1  6890  6891
6891  6890  H    -28.725603   16.148538   -6.337332     2  6889
6892  6891  H    -28.986073   14.675838   -6.572287     2  6889
6893  6892  O    -23.237900    2.096658    1.843843     1  6893  6894
6894  6893  H    -24.004057    2.627105    1.625070     2  6892
6895  6894  H    -23.542405    1.192383    1.767706     2  6892
6896  6895  O     -2.395611  -24.288133   21.599896     1  6896  6897
6897  6896  H     -3.100579  -24.837318   21.942892     2  6895
6898  6897  H     -1.611218  -24.591105   22.057245     2  6895
6899  6898  O     32.890259  -12.179757    8.035761     1  6899  6900
6900  6899  H     33.606927  -12.466695    7.469823     2  6898
6901  6900  H     32.188087  -12.809241    7.871634     2  6898
6902  6901  O    -12.195447   18.914433   -3.125900     1  6902  6903
6903  6902  H    -11.967478   19.466406   -3.873957     2  6901
6904  6903  H    -12.405093   19.533083   -2.426220     2  6901
6905  6904  O     -7.087731   33.580933   -9.431841     1  6905  6906
6906  6905  H     -6.242526   33.921273   -9.725146     2  6904
6907  6906  H     -7.110596   33.771004   -8.493981     2  6904
6908  6907  O    -25.319731   -4.343941  -24.695834     1  6908  6909
6909  6908  H    -24.533759   -3.998555  -24.272530     2  6907
6910  6909  H    -25.476812   -3.750988  -25.430655     2  6907
6911  6910  O    -23.083464   -0.345991  -28.536821     1  6911  6912
6912  6911  H    -22.325343   -0.086434  -28.013262     2  6910
6913  6912  H    -23.126904    0.306267  -29.236038     2  6910
6914  6913  O     -5.474075  -35.421012   -6.724328     1  6914  6915
6915  6914  H     -6.354559  -35.048149   -6.680127     2  6913
6916  6915  H     -5.447128  -36.058092   -6.010442     2  6913
6917  6916  O    -16.039784   20.062948   -3.503359     1  6917  6918
6918  6917  H    -16.122499   20.902035   -3.050233     2  6916
6919  6918  H    -15.435977   20.238436   -4.225060     2  6916
6920  6919  O    -14.863638   11.703564   -5.878837     1  6920  6921
6921  6920  H    -14.639054   11.075738   -5.192085     2  6919
6922  6921  H    -15.737375   12.015142   -5.642757     2  6919
6923  6922  O    -13.585724   16.504641   -2.892620     1  6923  6924
6924  6923  H    -13.006708   17.257453   -3.011975     2  6922
6925  6924  H    -13.856772   16.267368   -3.779449     2  6922
6926  6925  O    -10.914380   -0.902134  -30.461423     1  6926  6927
6927  6926  H    -11.631868   -0.946413  -29.829376     2  6925
6928  6927  H    -10.956785   -1.734961  -30.931352     2  6925
6929  6928  O    -27.071066   19.538218   -4.100855     1  6929  6930
6930  6929  H    -26.561490   19.509727   -4.910640     2  6928
6931  6930  H    -27.245397   18.619911   -3.894573     2  6928
6932  6931  O    -19.762642    0.216147  -24.713332     1  6932  6933
6933  6932  H    -19.974345    0.301200  -23.783720     2  6931
6934  6933  H    -19.844863   -0.720345  -24.893484     2  6931
6935  6934  O    -18.639737    4.844802  -22.332759     1  6935  6936
6936  6935  H    -18.667141    4.319388  -23.132397     2  6934
6937  6936  H    -19.540460    5.145442  -22.212157     2  6934
6938  6937  O    -23.272759    5.773109  -10.557146     1  6938  6939
6939  6938  H    -23.373780    6.682415  -10.275741     2  6937
6940  6939  H    -24.165919    5.430052  -10.585574     2  6937
6941  6940  O    -11.419364   25.410319   -2.048008     1  6941  6942
6942  6941  H    -10.866875   26.001449   -2.559431     2  6940
6943  6942  H    -11.085531   25.483268   -1.153880     2  6940
6944  6943  O    -19.153799    4.340995   -8.905274     1  6944  6945
6945  6944  H    -19.753286    4.599743   -9.605200     2  6943
6946  6945  H    -18.336753    4.127350   -9.355854     2  6943
6947  6946  O      0.601920   22.631487    0.121912     1  6947  6948
6948  6947  H      0.201169   23.352537   -0.363595     2  6946
6949  6948  H      1.497092   22.584404   -0.213769     2  6946
6950  6949  O     32.741657   -6.984794    3.965104     1  6950  6951
6951  6950  H     33.029215   -7.888311    4.096255     2  6949
6952  6951  H     31.790605   -7.018283    4.068113     2  6949
6953  6952  O    -33.368528    7.387520   -4.457375     1  6953  6954
6954  6953  H    -33.701216    8.242159   -4.183255     2  6952
6955  6954  H    -32.495335    7.569974   -4.804473     2  6952
6956  6955  O    -27.379206    8.381162    2.794551     1  6956  6957
6957  6956  H    -26.424223    8.428180    2.749530     2  6955
6958  6957  H    -27.589015    8.621128    3.697119     2  6955
6959  6958  O     16.310191   -4.364529   33.533684     1  6959  6960
6960  6959  H     16.039824   -4.793013   34.345801     2  6958
6961  6960  H     16.201097   -3.429636   33.707767     2  6958
6962  6961  O     -1.715252   28.826352  -23.390926     1  6962  6963
6963  6962  H     -2.570731   29.166283  -23.653292     2  6961
6964  6963  H     -1.130432   29.582347  -23.442760     2  6961
6965  6964  O     -9.765080   22.054080  -12.872832     1  6965  6966
6966  6965  H     -8.845786   21.957099  -12.624385     2  6964
6967  6966  H     -9.739851   22.518103  -13.709658     2  6964
6968  6967  O      2.387536   32.942285  -14.011948     1  6968  6969
6969  6968  H      1.988312   32.599599  -14.811584     2  6967
6970  6969  H      1.700116   32.868682  -13.349930     2  6967
6971  6970  O    -22.926422   19.458282  -11.690596     1  6971  6972
6972  6971  H    -22.880928   18.899932  -12.466744     2  6970
6973  6972  H    -22.066852   19.877011  -11.645470     2  6970
6974  6973  O      6.270037   33.051167   12.079536     1  6974  6975
6975  6974  H      7.000072   32.437231   12.159310     2  6973
6976  6975  H      5.487817   32.506967   12.170151     2  6973
6977  6976  O    -10.176104   27.262121   -3.418143     1  6977  6978
6978  6977  H    -10.147598   27.274324   -4.374840     2  6976
6979  6978  H    -10.362380   28.168188   -3.172022     2  6976
6980  6979  O     -0.764309    7.133280   -2.311867     1  6980  6981
6981  6980  H     -1.466853    6.656616   -1.869764     2  6979
6982  6981  H     -0.532939    7.836730   -1.705354     2  6979
6983  6982  O    -23.302456   -0.630245   -8.760010     1  6983  6984
6984  6983  H    -22.453493   -0.360501   -9.110341     2  6982
6985  6984  H    -23.087306   -1.191510   -8.015078     2  6982
6986  6985  O      7.247700   18.441718  -14.687664     1  6986  6987
6987  6986  H      7.019065   19.055649  -15.385551     2  6985
6988  6987  H      6.433596   17.972863  -14.504247     2  6985
6989  6988  O    -11.896064    4.224419  -19.649939     1  6989  6990
6990  6989  H    -12.559803    3.575692  -19.884109     2  6988
6991  6990  H    -11.364478    4.319898  -20.440212     2  6988
6992  6991  O    -20.764384   30.258482   -0.715302     1  6992  6993
6993  6992  H    -19.925508   30.380507   -0.270749     2  6991
6994  6993  H    -20.925215   29.315986   -0.669844     2  6991
6995  6994  O    -20.850178   23.335522   -2.720584     1  6995  6996
6996  6995  H    -21.513631   23.936555   -2.381733     2  6994
6997  6996  H    -20.232855   23.898267   -3.187984     2  6994
6998  6997  O      3.613410  -29.381819   17.173581     1  6998  6999
6999  6998  H      3.850683  -28.957827   17.998302     2  6997
7000  6999  H      2.692256  -29.618486   17.281732     2  6997
7001  7000  O    -18.103893   12.619551  -10.520839     1  7001  7002
7002  7001  H    -17.314067   12.334097  -10.980101     2  7000
7003  7002  H    -17.783408   13.199057   -9.829685     2  7000
7004  7003  O    -26.099843   10.687051   -1.366451     1  7004  7005
7005  7004  H    -26.510124   11.493851   -1.677857     2  7003
7006  7005  H    -26.673413   10.381984   -0.663469     2  7003
7007  7006  O     -2.554365   24.320399  -15.104218     1  7007  7008
7008  7007  H     -2.331643   24.095327  -14.200908     2  7006
7009  7008  H     -1.723305   24.587635  -15.496845     2  7006
7010  7009  O    -21.958587   23.711926    3.154711     1  7010  7011
7011  7010  H    -22.526743   24.450935    2.937234     2  7009
7012  7011  H    -21.126099   24.114070    3.402655     2  7009
7013  7012  O    -12.088552    7.727012   -6.856136     1  7013  7014
7014  7013  H    -12.272344    6.854264   -7.203645     2  7012
7015  7014  H    -11.332643    8.031071   -7.358512     2  7012
7016  7015  O     20.732383   -9.390785   22.377861     1  7016  7017
7017  7016  H     21.218048  -10.050107   22.873498     2  7015
7018  7017  H     21.395016   -8.752140   22.114644     2  7015
7019  7018  O     -2.185155   20.601799   -2.198004     1  7019  7020
7020  7019  H     -2.591709   19.738250   -2.270308     2  7018
7021  7020  H     -2.063206   20.731655   -1.257526     2  7018
7022  7021  O     -6.523269   16.911147  -11.229856     1  7022  7023
7023  7022  H     -7.112412   16.175570  -11.397393     2  7021
7024  7023  H     -6.299880   16.833272  -10.302352     2  7021
7025  7024  O    -26.041643   18.418817   -0.807912     1  7025  7026
7026  7025  H    -26.217875   18.525892   -1.742635     2  7024
7027  7026  H    -25.560376   17.593617   -0.747421     2  7024
7028  7027  O    -32.764323   -1.398084   -2.510476     1  7028  7029
7029  7028  H    -31.977079   -1.932848   -2.612971     2  7027
7030  7029  H    -33.265615   -1.553046   -3.311054     2  7027
7031  7030  O    -10.166817   29.792066   -2.518316     1  7031  7032
7032  7031  H    -10.023398   29.721140   -1.574584     2  7030
7033  7032  H    -11.099044   29.991205   -2.605091     2  7030
7034  7033  O     19.862049    3.767399   27.527176     1  7034  7035
7035  7034  H     19.592068    4.222465   26.729519     2  7033
7036  7035  H     19.490871    2.889422   27.439907     2  7033
7037  7036  O    -21.518919    8.928842   -5.025119     1  7037  7038
7038  7037  H    -21.539475    8.354004   -5.790214     2  7036
7039  7038  H    -20.822027    9.556823   -5.215417     2  7036
7040  7039  O    -24.607444    8.514281    3.129897     1  7040  7041
7041  7040  H    -24.049778    9.106476    3.634421     2  7039
7042  7041  H    -24.453179    7.652121    3.516050     2  7039
7043  7042  O     -0.280863    2.203942   -6.700871     1  7043  7044
7044  7043  H      0.552185    2.275562   -7.166847     2  7042
7045  7044  H     -0.101699    2.563988   -5.832252     2  7042
7046  7045  O    -30.325801   10.726411   -8.040131     1  7046  7047
7047  7046  H    -29.487200   10.507310   -7.633961     2  7045
7048  7047  H    -30.094297   11.040776   -8.914095     2  7045
7049  7048  O    -20.266529    8.911167    3.285452     1  7049  7050
7050  7049  H    -19.554218    8.678168    2.690007     2  7048
7051  7050  H    -19.902330    9.604705    3.835538     2  7048
7052  7051  O     -1.064924   28.615031   -1.724848     1  7052  7053
7053  7052  H     -0.619569   29.246151   -2.290159     2  7051
7054  7053  H     -1.148493   29.063687   -0.883447     2  7051
7055  7054  O     21.108184  -30.068694    1.047153     1  7055  7056
7056  7055  H     20.566657  -30.728147    0.613447     2  7054
7057  7056  H     20.905895  -30.166194    1.977639     2  7054
7058  7057  O    -10.650381   13.128946   -7.312923     1  7058  7059
7059  7058  H    -10.077835   13.499934   -7.984333     2  7057
7060  7059  H    -11.413081   13.707213   -7.301656     2  7057
7061  7060  O    -17.832715    7.556683    2.724658     1  7061  7062
7062  7061  H    -17.624426    8.490926    2.718554     2  7060
7063  7062  H    -17.442014    7.218427    1.918949     2  7060
7064  7063  O     -1.957762    4.864911   -8.111864     1  7064  7065
7065  7064  H     -1.986759    4.665921   -7.176025     2  7063
7066  7065  H     -2.674937    4.354641   -8.488050     2  7063
7067  7066  O    -13.557273    4.092121   32.126774     1  7067  7068
7068  7067  H    -12.899541    3.652456   31.587966     2  7066
7069  7068  H    -13.419963    5.024596   31.959835     2  7066
7070  7069  O    -11.550866   28.523144  -10.169325     1  7070  7071
7071  7070  H    -10.670337   28.202024  -10.363700     2  7069
7072  7071  H    -12.050546   28.351492  -10.967503     2  7069
7073  7072  O     -4.097255   28.152935  -14.254257     1  7073  7074
7074  7073  H     -4.850793   27.565344  -14.198145     2  7072
7075  7074  H     -4.449007   28.958863  -14.632386     2  7072
7076  7075  O    -21.093194   15.823823   -8.528745     1  7076  7077
7077  7076  H    -21.856680   16.401109   -8.520881     2  7075
7078  7077  H    -20.610072   16.075571   -9.315795     2  7075
7079  7078  O    -20.031177   12.183287  -16.407285     1  7079  7080
7080  7079  H    -20.244252   12.781537  -17.123475     2  7078
7081  7080  H    -19.286769   11.676343  -16.731471     2  7078
7082  7081  O     -4.863460   21.799229   -9.780030     1  7082  7083
7083  7082  H     -4.473856   21.033973   -9.357153     2  7081
7084  7083  H     -5.622878   22.012435   -9.237758     2  7081
7085  7084  O     -1.781576   24.665467   -5.508402     1  7085  7086
7086  7085  H     -1.791306   25.235119   -6.277579     2  7084
7087  7086  H     -1.011609   24.110123   -5.630779     2  7084
7088  7087  O     -8.111159   10.901754   -8.753284     1  7088  7089
7089  7088  H     -7.914266   10.630443   -7.856704     2  7087
7090  7089  H     -7.526415   11.642393   -8.913787     2  7087
7091  7090  O    -19.215937   14.948619   -3.596475     1  7091  7092
7092  7091  H    -19.731575   14.577432   -4.312414     2  7090
7093  7092  H    -18.305992   14.817786   -3.863149     2  7090
7094  7093  O     -1.739442    3.998337  -12.276543     1  7094  7095
7095  7094  H     -0.846689    4.045470  -11.934487     2  7093
7096  7095  H     -1.646711    3.580057  -13.132508     2  7093
7097  7096  O    -12.363167   15.301214   -7.459312     1  7097  7098
7098  7097  H    -12.931928   15.215845   -6.694162     2  7096
7099  7098  H    -11.981674   16.175372   -7.378427     2  7096
7100  7099  O     15.881267  -19.178192   18.370800     1  7100  7101
7101  7100  H     15.688881  -19.013405   19.293873     2  7099
7102  7101  H     15.064918  -18.972824   17.915135     2  7099
7103  7102  O     -2.690913   34.009753  -11.670939     1  7103  7104
7104  7103  H     -2.014134   33.376438  -11.909921     2  7102
7105  7104  H     -2.347793   34.851900  -11.969754     2  7102
7106  7105  O     -7.766501   22.493619  -15.439469     1  7106  7107
7107  7106  H     -7.925323   23.004492  -16.233205     2  7105
7108  7107  H     -7.268751   21.732954  -15.739242     2  7105
7109  7108  O    -30.044083    6.024585   -3.847185     1  7109  7110
7110  7109  H    -29.979302    6.674355   -3.147303     2  7108
7111  7110  H    -30.430969    6.500902   -4.581809     2  7108
7112  7111  O    -27.054938    8.288942  -17.341927     1  7112  7113
7113  7112  H    -27.417030    7.717320  -16.664898     2  7111
7114  7113  H    -27.812169    8.549340  -17.866356     2  7111
7115  7114  O      8.103851  -24.553805   21.323955     1  7115  7116
7116  7115  H      8.759760  -24.342226   20.659689     2  7114
7117  7116  H      8.418919  -25.365065   21.722479     2  7114
7118  7117  O     -7.990647   26.569963   -8.380892     1  7118  7119
7119  7118  H     -8.486493   26.859909   -9.146595     2  7117
7120  7119  H     -7.079308   26.563333   -8.673552     2  7117
7121  7120  O    -17.271447   16.264121  -15.344660     1  7121  7122
7122  7121  H    -17.503843   17.068273  -15.808948     2  7120
7123  7122  H    -17.138658   15.616932  -16.037296     2  7120
7124  7123  O    -26.853626    2.166778   -2.007291     1  7124  7125
7125  7124  H    -27.509204    1.760598   -2.574272     2  7123
7126  7125  H    -26.989577    3.107668   -2.118984     2  7123
7127  7126  O    -13.595014   21.883482   -1.063821     1  7127  7128
7128  7127  H    -14.002498   21.135314   -0.627434     2  7126
7129  7128  H    -13.970299   22.648872   -0.628426     2  7126
7130  7129  O    -20.593602    6.559106  -20.897718     1  7130  7131
7131  7130  H    -21.309114    5.962235  -20.678586     2  7129
7132  7131  H    -20.671281    7.270486  -20.262001     2  7129
7133  7132  O    -15.182854    6.172411  -21.932187     1  7133  7134
7134  7133  H    -15.875825    6.016040  -21.290649     2  7132
7135  7134  H    -14.832743    5.302460  -22.124123     2  7132
7136  7135  O    -17.603668   11.960886   -5.194197     1  7136  7137
7137  7136  H    -17.884897   12.642599   -5.804450     2  7135
7138  7137  H    -17.793831   11.139603   -5.647588     2  7135
7139  7138  O    -16.739134    3.766176    3.115417     1  7139  7140
7140  7139  H    -17.440156    4.251918    2.680843     2  7138
7141  7140  H    -15.933990    4.105421    2.724407     2  7138
7142  7141  O    -11.680775    7.672432   -2.808535     1  7142  7143
7143  7142  H    -12.304733    7.718100   -3.532981     2  7141
7144  7143  H    -11.283936    6.804994   -2.887918     2  7141
7145  7144  O    -15.147154   11.397435  -25.711127     1  7145  7146
7146  7145  H    -15.631448   10.740614  -25.210850     2  7144
7147  7146  H    -14.788104   11.987304  -25.048278     2  7144
7148  7147  O     -8.163369    2.161934   -4.165099     1  7148  7149
7149  7148  H     -7.448842    1.535730   -4.048690     2  7147
7150  7149  H     -8.911227    1.757113   -3.725713     2  7147
7151  7150  O      3.210752    7.336689   -5.596407     1  7151  7152
7152  7151  H      3.274967    7.371731   -6.550807     2  7150
7153  7152  H      4.048601    6.970914   -5.312772     2  7150
7154  7153  O    -14.997316   -0.751032  -21.314594     1  7154  7155
7155  7154  H    -14.861038   -0.972178  -20.393315     2  7153
7156  7155  H    -14.437207   -1.361948  -21.793437     2  7153
7157  7156  O    -19.339279   21.995594   -0.682803     1  7157  7158
7158  7157  H    -19.946343   22.016258   -1.422585     2  7156
7159  7158  H    -19.903435   21.960622    0.089684     2  7156
7160  7159  O     -7.344554   12.842466  -13.733087     1  7160  7161
7161  7160  H     -7.458997   12.205913  -13.027443     2  7159
7162  7161  H     -8.233857   13.121276  -13.951346     2  7159
7163  7162  O     -5.551358  -36.128531  -10.888411     1  7163  7164
7164  7163  H     -6.358828  -35.964315  -10.401321     2  7162
7165  7164  H     -5.039335  -36.701799  -10.317948     2  7162
7166  7165  O     21.772665   -7.059826   24.656939     1  7166  7167
7167  7166  H     22.428032   -7.626699   24.250268     2  7165
7168  7167  H     21.331265   -7.621784   25.293806     2  7165
7169  7168  O     -5.322407   10.823798  -10.907338     1  7169  7170
7170  7169  H     -6.215410   10.705651  -11.231094     2  7168
7171  7170  H     -5.017107   11.625273  -11.332382     2  7168
7172  7171  O    -12.245249   -1.470289  -21.910806     1  7172  7173
7173  7172  H    -11.818719   -1.010404  -21.187750     2  7171
7174  7173  H    -11.919675   -2.368321  -21.849389     2  7171
7175  7174  O    -24.472596    3.615815  -14.989099     1  7175  7176
7176  7175  H    -25.387186    3.509194  -14.727585     2  7174
7177  7176  H    -23.978671    3.103388  -14.349030     2  7174
7178  7177  O    -34.989742    3.903105   -1.098980     1  7178  7179
7179  7178  H    -34.162475    4.274252   -0.792205     2  7177
7180  7179  H    -35.336844    3.431816   -0.341591     2  7177
7181  7180  O    -27.257464   11.061897   -8.051464     1  7181  7182
7182  7181  H    -27.208169   10.230677   -7.579369     2  7180
7183  7182  H    -26.370809   11.419104   -8.001699     2  7180
7184  7183  O     34.241204    4.427377   -0.580333     1  7184  7185
7185  7184  H     34.438786    4.354642    0.353425     2  7183
7186  7185  H     34.777896    5.159962   -0.882844     2  7183
7187  7186  O     -1.688912   16.132518   -6.021453     1  7187  7188
7188  7187  H     -1.045633   16.058625   -5.316498     2  7186
7189  7188  H     -1.169383   16.330494   -6.800637     2  7186
7190  7189  O    -12.373830   -0.455363    7.604657     1  7190  7191
7191  7190  H    -12.455127   -1.381948    7.830625     2  7189
7192  7191  H    -11.815445   -0.089185    8.290480     2  7189
7193  7192  O     -0.337606   16.803110  -34.453754     1  7193  7194
7194  7193  H     -0.536363   17.554753  -35.012108     2  7192
7195  7194  H     -1.145375   16.647436  -33.964361     2  7192
7196  7195  O    -31.817225    6.237161   12.196881     1  7196  7197
7197  7196  H    -32.061390    6.876801   12.865817     2  7195
7198  7197  H    -30.930127    6.487043   11.938333     2  7195
7199  7198  O     -9.046757    9.915496   21.962223     1  7199  7200
7200  7199  H     -9.652821    9.218816   21.710121     2  7198
7201  7200  H     -9.322395   10.165929   22.844004     2  7198
7202  7201  O    -19.648456   20.628660   10.820710     1  7202  7203
7203  7202  H    -19.425480   21.165491   10.060233     2  7201
7204  7203  H    -20.602623   20.557752   10.792956     2  7201
7205  7204  O     -1.766134   11.836022  -33.911634     1  7205  7206
7206  7205  H     -1.857706   12.230668  -33.044396     2  7204
7207  7206  H     -1.797734   12.576835  -34.516968     2  7204
7208  7207  O    -21.974082   20.733168    7.537205     1  7208  7209
7209  7208  H    -22.106586   19.785467    7.560413     2  7207
7210  7209  H    -22.181424   20.982495    6.636606     2  7207
7211  7210  O     18.928709  -28.323312   -0.178433     1  7211  7212
7212  7211  H     19.200728  -27.406573   -0.221189     2  7210
7213  7212  H     19.615079  -28.753781    0.331297     2  7210
7214  7213  O      3.573502    3.640476   23.549866     1  7214  7215
7215  7214  H      2.771193    3.660798   24.071516     2  7213
7216  7215  H      3.425605    4.284092   22.856961     2  7213
7217  7216  O     -2.061616   15.173191   22.263245     1  7217  7218
7218  7217  H     -2.926531   15.361065   21.898749     2  7216
7219  7218  H     -1.908865   15.876991   22.893773     2  7216
7220  7219  O     -4.079703    8.265999   10.862989     1  7220  7221
7221  7220  H     -3.531616    7.500432   11.035440     2  7219
7222  7221  H     -3.550132    9.009870   11.150117     2  7219
7223  7222  O     -9.183415    1.244688   24.928742     1  7223  7224
7224  7223  H     -8.454916    1.442939   25.517145     2  7222
7225  7224  H     -8.767556    1.051826   24.088446     2  7222
7226  7225  O    -11.881028   26.210031   12.013129     1  7226  7227
7227  7226  H    -12.725088   25.852921   11.736966     2  7225
7228  7227  H    -11.572521   25.603512   12.686323     2  7225
7229  7228  O    -25.395390   13.885891   -3.956256     1  7229  7230
7230  7229  H    -26.047494   13.948466   -4.654165     2  7228
7231  7230  H    -25.757419   14.410084   -3.241841     2  7228
7232  7231  O    -17.277326    0.927672   20.437806     1  7232  7233
7233  7232  H    -17.023922    0.275313   19.784778     2  7231
7234  7233  H    -16.451281    1.325700   20.712496     2  7231
7235  7234  O     -2.295699   13.965689    5.863094     1  7235  7236
7236  7235  H     -2.621207   14.836427    5.634856     2  7234
7237  7236  H     -2.004797   13.592516    5.031019     2  7234
7238  7237  O    -23.617254   11.515359   -0.087660     1  7238  7239
7239  7238  H    -23.560653   11.943712   -0.941793     2  7237
7240  7239  H    -24.411926   10.984121   -0.137794     2  7237
7241  7240  O     -9.062774    8.168242   18.115217     1  7241  7242
7242  7241  H     -9.668359    8.059009   18.848406     2  7240
7243  7242  H     -8.856995    9.103052   18.111143     2  7240
7244  7243  O    -10.445501   12.440811   20.100652     1  7244  7245
7245  7244  H    -10.574433   11.521814   19.866018     2  7243
7246  7245  H     -9.560378   12.473942   20.463547     2  7243
7247  7246  O     18.451075   -3.561965  -30.119839     1  7247  7248
7248  7247  H     18.465464   -3.040808  -30.922596     2  7246
7249  7248  H     18.617148   -2.929957  -29.420398     2  7246
7250  7249  O    -12.893237    4.270603   20.413155     1  7250  7251
7251  7250  H    -12.034584    3.856783   20.325412     2  7249
7252  7251  H    -12.892608    4.966398   19.755812     2  7249
7253  7252  O    -17.458575   10.190575    2.335831     1  7253  7254
7254  7253  H    -16.695272   10.057656    1.773753     2  7252
7255  7254  H    -17.438041   11.122832    2.551950     2  7252
7256  7255  O     -6.123737   25.097706   17.431770     1  7256  7257
7257  7256  H     -5.606418   24.340505   17.157437     2  7255
7258  7257  H     -6.666515   24.770388   18.149047     2  7255
7259  7258  O    -24.039594    5.766766    9.279850     1  7259  7260
7260  7259  H    -24.236300    6.631524    9.640033     2  7258
7261  7260  H    -23.555005    5.946888    8.474269     2  7258
7262  7261  O     33.814088    4.457884   12.446678     1  7262  7263
7263  7262  H     34.135258    4.048396   13.250047     2  7261
7264  7263  H     33.088772    3.899769   12.166224     2  7261
7265  7264  O    -21.773290    0.141958    8.346413     1  7265  7266
7266  7265  H    -22.245142    0.587760    9.049866     2  7264
7267  7266  H    -20.857476    0.157335    8.624410     2  7264
7268  7267  O     -2.087322   19.122111   25.421598     1  7268  7269
7269  7268  H     -2.695597   19.366635   26.119051     2  7267
7270  7269  H     -2.594120   19.220897   24.615602     2  7267
7271  7270  O     -5.293707   18.272407   -2.745260     1  7271  7272
7272  7271  H     -5.924699   18.980356   -2.875225     2  7270
7273  7272  H     -5.276838   17.809214   -3.582755     2  7270
7274  7273  O    -14.969145    3.395604   25.938084     1  7274  7275
7275  7274  H    -14.513165    2.865633   25.284293     2  7273
7276  7275  H    -15.857886    3.040637   25.957342     2  7273
7277  7276  O    -23.418810   12.751084   17.283152     1  7277  7278
7278  7277  H    -23.089173   12.625504   18.172984     2  7276
7279  7278  H    -23.413349   13.699902   17.156877     2  7276
7280  7279  O    -19.250649   18.987178    4.810090     1  7280  7281
7281  7280  H    -18.658218   18.274246    4.571374     2  7279
7282  7281  H    -20.101785   18.717713    4.464855     2  7279
7283  7282  O    -11.563433   15.063344   10.981553     1  7283  7284
7284  7283  H    -12.345799   14.512454   10.955959     2  7282
7285  7284  H    -11.895414   15.943609   11.158054     2  7282
7286  7285  O    -22.349958   -0.040872   16.740384     1  7286  7287
7287  7286  H    -22.909625    0.030172   17.513660     2  7285
7288  7287  H    -21.775885   -0.783721   16.927055     2  7285
7289  7288  O     -0.202502   14.574408   14.199643     1  7289  7290
7290  7289  H     -0.929638   13.959587   14.297111     2  7288
7291  7290  H     -0.356783   15.237216   14.872781     2  7288
7292  7291  O    -35.768360    1.229481    4.752846     1  7292  7293
7293  7292  H    -35.492763    1.090290    5.658883     2  7291
7294  7293  H    -34.999528    1.604129    4.322999     2  7291
7295  7294  O     -3.541686   18.597256    4.774789     1  7295  7296
7296  7295  H     -3.492111   19.262728    4.088552     2  7294
7297  7296  H     -4.146225   18.963001    5.420540     2  7294
7298  7297  O    -12.822381    6.553712    3.651223     1  7298  7299
7299  7298  H    -13.771012    6.672183    3.603302     2  7297
7300  7299  H    -12.681597    6.071610    4.466078     2  7297
7301  7300  O    -10.977753    6.943645   19.746180     1  7301  7302
7302  7301  H    -10.763686    6.051570   20.019331     2  7300
7303  7302  H    -11.372389    7.343718   20.521057     2  7300
7304  7303  O    -25.719836   12.509332   12.834090     1  7304  7305
7305  7304  H    -25.557624   12.551273   13.776513     2  7303
7306  7305  H    -24.909464   12.828059   12.436672     2  7303
7307  7306  O     17.687643  -23.224433  -13.033110     1  7307  7308
7308  7307  H     17.833151  -22.909746  -13.925316     2  7306
7309  7308  H     17.615096  -22.428298  -12.506671     2  7306
7310  7309  O    -25.747445   12.435990    2.474204     1  7310  7311
7311  7310  H    -24.872273   12.048800    2.493898     2  7309
7312  7311  H    -26.302351   11.797822    2.922593     2  7309
7313  7312  O     33.780857    5.920448    9.028714     1  7313  7314
7314  7313  H     33.108412    5.494042    9.559964     2  7312
7315  7314  H     34.606260    5.556850    9.349243     2  7312
7316  7315  O    -18.198216   11.418382    8.873034     1  7316  7317
7317  7316  H    -18.107052   12.141003    8.251955     2  7315
7318  7317  H    -19.067785   11.059016    8.697142     2  7315
7319  7318  O    -21.499930   -7.092291   13.865079     1  7319  7320
7320  7319  H    -21.104305   -6.676093   13.099251     2  7318
7321  7320  H    -22.391164   -6.744280   13.893756     2  7318
7322  7321  O    -22.590818   13.128694    8.769826     1  7322  7323
7323  7322  H    -21.763507   13.052321    8.294477     2  7321
7324  7323  H    -23.022231   12.284476    8.637877     2  7321
7325  7324  O    -31.235732    3.960281    1.967009     1  7325  7326
7326  7325  H    -31.918787    3.598650    2.531713     2  7324
7327  7326  H    -30.442994    3.484153    2.214193     2  7324
7328  7327  O    -21.087273   13.092332    3.908940     1  7328  7329
7329  7328  H    -21.592256   12.685563    3.204836     2  7327
7330  7329  H    -21.164954   14.032646    3.747677     2  7327
7331  7330  O      4.644876   16.064528   18.171533     1  7331  7332
7332  7331  H      4.288763   16.101697   17.283820     2  7330
7333  7332  H      4.931885   16.959545   18.352644     2  7330
7334  7333  O      3.337027   17.360720   26.688526     1  7334  7335
7335  7334  H      2.403052   17.556819   26.762465     2  7333
7336  7335  H      3.750732   17.907988   27.356042     2  7333
7337  7336  O    -21.507379   15.602719    6.152394     1  7337  7338
7338  7337  H    -21.516758   14.826902    6.712976     2  7336
7339  7338  H    -20.691379   15.531114    5.657168     2  7336
7340  7339  O     -9.461584   -8.363102   11.323199     1  7340  7341
7341  7340  H     -9.067777   -8.548206   10.470624     2  7339
7342  7341  H     -9.435601   -9.200352   11.786414     2  7339
7343  7342  O     16.981677  -30.827461   -4.267114     1  7343  7344
7344  7343  H     17.633572  -30.640920   -3.591490     2  7342
7345  7344  H     17.423872  -30.621427   -5.090670     2  7342
7346  7345  O    -14.897129    5.183400   16.604973     1  7346  7347
7347  7346  H    -15.189835    4.793952   17.428918     2  7345
7348  7347  H    -15.306908    6.048311   16.589410     2  7345
7349  7348  O     -7.719274   32.579973   10.802174     1  7349  7350
7350  7349  H     -7.873520   32.722888   11.735992     2  7348
7351  7350  H     -8.131654   31.736197   10.617196     2  7348
7352  7351  O     35.673120    4.750194    2.135845     1  7352  7353
7353  7352  H     36.140656    3.971389    1.834008     2  7351
7354  7353  H     35.178075    4.452204    2.898973     2  7351
7355  7354  O     -8.876880   15.669206   10.536293     1  7355  7356
7356  7355  H     -9.705555   15.197881   10.622214     2  7354
7357  7356  H     -8.205541   15.003593   10.686271     2  7354
7358  7357  O    -14.791895    4.418155   22.772226     1  7358  7359
7359  7358  H    -13.996429    4.225724   23.268650     2  7357
7360  7359  H    -14.479542    4.844983   21.974426     2  7357
7361  7360  O      4.523439   18.989428   14.071057     1  7361  7362
7362  7361  H      4.967709   18.265522   14.512436     2  7360
7363  7362  H      4.142464   18.594689   13.286665     2  7360
7364  7363  O     -4.699492   11.387131    9.562957     1  7364  7365
7365  7364  H     -3.790315   11.672516    9.653434     2  7363
7366  7365  H     -5.048040   11.410060   10.454148     2  7363
7367  7366  O     -1.755168  -33.912952  -16.288394     1  7367  7368
7368  7367  H     -1.914053  -33.654071  -15.380668     2  7366
7369  7368  H     -1.182263  -33.229497  -16.636102     2  7366
7370  7369  O    -27.528931    8.254947    5.388879     1  7370  7371
7371  7370  H    -27.976333    8.317390    6.232777     2  7369
7372  7371  H    -26.691721    7.837467    5.591417     2  7369
7373  7372  O    -20.933539   27.770993    5.180203     1  7373  7374
7374  7373  H    -20.855902   27.914905    6.123332     2  7372
7375  7374  H    -20.285834   27.093292    4.986728     2  7372
7376  7375  O     -9.489265    3.546248   28.056555     1  7376  7377
7377  7376  H    -10.192261    3.159598   27.534510     2  7375
7378  7377  H     -8.789706    3.719125   27.426506     2  7375
7379  7378  O    -11.874172   18.840810   16.876498     1  7379  7380
7380  7379  H    -11.532982   18.622071   17.743662     2  7378
7381  7380  H    -11.113609   19.164974   16.394115     2  7378
7382  7381  O     -3.833158   34.042992    8.521482     1  7382  7383
7383  7382  H     -4.276639   33.575246    9.229133     2  7381
7384  7383  H     -3.052873   33.519228    8.339665     2  7381
7385  7384  O    -12.506000    4.484311   17.481308     1  7385  7386
7386  7385  H    -13.272857    4.593701   16.918996     2  7384
7387  7386  H    -11.759193    4.605263   16.894893     2  7384
7388  7387  O     33.368070    4.901852    6.597088     1  7388  7389
7389  7388  H     32.526441    5.287159    6.353305     2  7387
7390  7389  H     33.626161    5.371298    7.390336     2  7387
7391  7390  O    -12.515187   17.690736   10.873387     1  7391  7392
7392  7391  H    -13.426647   17.544317   11.126433     2  7390
7393  7392  H    -12.087521   17.986380   11.677084     2  7390
7394  7393  O    -16.591851    4.909597    6.802410     1  7394  7395
7395  7394  H    -17.371000    5.296113    6.402706     2  7393
7396  7395  H    -16.240654    5.602094    7.362179     2  7393
7397  7396  O    -21.529837   -1.725443    6.503586     1  7397  7398
7398  7397  H    -20.941529   -2.333463    6.951287     2  7396
7399  7398  H    -21.606551   -0.981747    7.101300     2  7396
7400  7399  O    -11.446513   12.420501   14.100815     1  7400  7401
7401  7400  H    -12.284648   12.650573   14.501848     2  7399
7402  7401  H    -11.466750   11.465894   14.033367     2  7399
7403  7402  O    -22.317890    6.264412   19.415870     1  7403  7404
7404  7403  H    -23.129714    6.749397   19.564070     2  7402
7405  7404  H    -22.494236    5.389705   19.762311     2  7402
7406  7405  O    -23.637156    1.620058    6.321950     1  7406  7407
7407  7406  H    -24.280068    1.223271    6.909706     2  7405
7408  7407  H    -22.793269    1.292498    6.633062     2  7405
7409  7408  O     -4.743148    8.076183    3.588473     1  7409  7410
7410  7409  H     -4.808994    7.166841    3.880007     2  7408
7411  7410  H     -3.802675    8.252504    3.562909     2  7408
7412  7411  O    -19.961858   -3.227299    8.486622     1  7412  7413
7413  7412  H    -19.932037   -3.452139    9.416563     2  7411
7414  7413  H    -19.246407   -2.602626    8.367690     2  7411
7415  7414  O    -20.264067    3.488329    8.354911     1  7415  7416
7416  7415  H    -20.091007    4.258135    7.812989     2  7414
7417  7416  H    -19.562878    2.875821    8.132650     2  7414
7418  7417  O     -3.237614    5.785336   29.907967     1  7418  7419
7419  7418  H     -3.351628    6.733402   29.841612     2  7417
7420  7419  H     -3.973834    5.420150   29.417203     2  7417
7421  7420  O    -25.594048    6.524471    6.488244     1  7421  7422
7422  7421  H    -26.127352    5.780297    6.208919     2  7420
7423  7422  H    -25.610576    6.486060    7.444530     2  7420
7424  7423  O    -15.073171   -0.030121    7.702013     1  7424  7425
7425  7424  H    -14.136657   -0.018475    7.899592     2  7423
7426  7425  H    -15.243075    0.819234    7.294630     2  7423
7427  7426  O     -5.732910  -35.050327    6.382397     1  7427  7428
7428  7427  H     -6.562652  -34.928719    5.920908     2  7426
7429  7428  H     -5.482497  -35.954302    6.191727     2  7426
7430  7429  O     -6.187126    6.966208   12.122266     1  7430  7431
7431  7430  H     -6.545062    6.704778   11.273875     2  7429
7432  7431  H     -5.304118    7.278226   11.924344     2  7429
7433  7432  O     34.657376    4.168139   -3.342457     1  7433  7434
7434  7433  H     33.808653    4.251906   -3.777065     2  7432
7435  7434  H     34.453010    4.203452   -2.407995     2  7432
7436  7435  O    -23.716803   -0.798777   11.197498     1  7436  7437
7437  7436  H    -23.396933   -1.082350   12.053945     2  7435
7438  7437  H    -23.814826   -1.609146   10.697572     2  7435
7439  7438  O      6.008486  -19.168274  -23.474076     1  7439  7440
7440  7439  H      5.802686  -19.550955  -22.621179     2  7438
7441  7440  H      6.572757  -19.815206  -23.897523     2  7438
7442  7441  O      0.783192   14.371524   10.235819     1  7442  7443
7443  7442  H      0.481812   13.766427   10.913506     2  7441
7444  7443  H      0.696022   13.879925    9.419140     2  7441
7445  7444  O    -11.331177    1.530233   17.510174     1  7445  7446
7446  7445  H    -11.477394    2.464638   17.657620     2  7444
7447  7446  H    -11.854574    1.096180   18.183884     2  7444
7448  7447  O    -11.995305    8.395417    5.687090     1  7448  7449
7449  7448  H    -11.088800    8.256422    5.961246     2  7447
7450  7449  H    -12.098286    7.845111    4.910695     2  7447
7451  7450  O    -20.016227   13.847814    7.908080     1  7451  7452
7452  7451  H    -19.238960   14.238143    7.508415     2  7450
7453  7452  H    -20.144883   14.343512    8.716759     2  7450
7454  7453  O     -5.227964    4.696900   28.181484     1  7454  7455
7455  7454  H     -5.462309    3.769045   28.161514     2  7453
7456  7455  H     -6.056441    5.150374   28.337107     2  7453
7457  7456  O    -15.299291    9.394227   20.925301     1  7457  7458
7458  7457  H    -16.137161    9.856011   20.956317     2  7456
7459  7458  H    -15.207179    9.005480   21.795142     2  7456
7460  7459  O    -20.489906    1.891117    1.660868     1  7460  7461
7461  7460  H    -21.432038    1.974058    1.808312     2  7459
7462  7461  H    -20.287535    0.987741    1.904155     2  7459
7463  7462  O    -25.081880    4.469164   14.516396     1  7463  7464
7464  7463  H    -25.712814    5.057012   14.931835     2  7462
7465  7464  H    -25.395945    4.376993   13.616896     2  7462
7466  7465  O    -18.026403    8.968923   18.113880     1  7466  7467
7467  7466  H    -17.140936    9.262021   17.898771     2  7465
7468  7467  H    -18.319602    9.572151   18.796802     2  7465
7469  7468  O    -17.966323   16.374721   12.915002     1  7469  7470
7470  7469  H    -18.386922   16.916376   12.247216     2  7468
7471  7470  H    -17.784925   16.978972   13.634868     2  7468
7472  7471  O      2.758810  -20.553207  -27.269422     1  7472  7473
7473  7472  H      2.911504  -20.258075  -26.371751     2  7471
7474  7473  H      1.824817  -20.403279  -27.415744     2  7471
7475  7474  O     19.914412  -25.604963   -0.882132     1  7475  7476
7476  7475  H     19.941678  -24.653522   -0.983365     2  7474
7477  7476  H     20.666068  -25.808729   -0.325604     2  7474
7478  7477  O      2.066101   13.867573    1.000824     1  7478  7479
7479  7478  H      1.743761   14.768849    1.006380     2  7477
7480  7479  H      3.009903   13.951083    0.864828     2  7477
7481  7480  O     -7.411477   13.147183   11.045844     1  7481  7482
7482  7481  H     -7.271540   12.760661   10.181408     2  7480
7483  7482  H     -8.333815   12.977984   11.237930     2  7480
7484  7483  O     -6.780750    2.147073   26.362305     1  7484  7485
7485  7484  H     -6.549942    1.860841   27.246064     2  7483
7486  7485  H     -6.547202    1.407172   25.801740     2  7483
7487  7486  O    -10.572041   -1.276854   34.244027     1  7487  7488
7488  7487  H     -9.705843   -1.382306   34.637489     2  7486
7489  7488  H    -10.395316   -0.991287   33.347672     2  7486
7490  7489  O      4.610502   14.002814   19.920663     1  7490  7491
7491  7490  H      5.475148   13.944065   20.327071     2  7489
7492  7491  H      4.709478   14.669791   19.241268     2  7489
7493  7492  O    -16.351820    1.420676   17.059267     1  7493  7494
7494  7493  H    -15.711329    1.609330   16.373401     2  7492
7495  7494  H    -16.495536    2.262526   17.491546     2  7492
7496  7495  O     -8.094858    9.397887    3.732385     1  7496  7497
7497  7496  H     -7.202026    9.568722    4.032216     2  7495
7498  7497  H     -8.016758    8.623875    3.174678     2  7495
7499  7498  O     -6.929697    9.128530   28.488677     1  7499  7500
7500  7499  H     -6.577511    9.583484   29.253669     2  7498
7501  7500  H     -6.965797    8.208943   28.751906     2  7498
7502  7501  O    -25.721532   10.364991    9.966735     1  7502  7503
7503  7502  H    -25.803450   10.368807   10.920415     2  7501
7504  7503  H    -26.356459   11.016361    9.668717     2  7501
7505  7504  O     -7.944769   -1.685868   16.317179     1  7505  7506
7506  7505  H     -8.104994   -1.154555   17.097093     2  7504
7507  7506  H     -8.813386   -1.984067   16.047338     2  7504
7508  7507  O    -21.929988   -1.800580   20.972439     1  7508  7509
7509  7508  H    -22.348596   -2.557093   21.383153     2  7507
7510  7509  H    -21.006222   -1.878712   21.210735     2  7507
7511  7510  O    -20.197255    3.568371   28.291057     1  7511  7512
7512  7511  H    -20.664149    2.790553   28.596411     2  7510
7513  7512  H    -19.667239    3.257438   27.557140     2  7510
7514  7513  O    -19.321728    6.538267   18.694316     1  7514  7515
7515  7514  H    -19.164820    7.477807   18.600102     2  7513
7516  7515  H    -19.948630    6.329031   18.001897     2  7513
7517  7516  O      3.821327  -19.163189  -31.415925     1  7517  7518
7518  7517  H      4.014803  -20.080894  -31.607282     2  7516
7519  7518  H      4.429696  -18.669879  -31.966166     2  7516
7520  7519  O      2.289519   17.946537    3.932309     1  7520  7521
7521  7520  H      2.604576   18.849232    3.886343     2  7519
7522  7521  H      2.687925   17.593517    4.727847     2  7519
7523  7522  O      0.117771  -32.716172    9.112926     1  7523  7524
7524  7523  H      0.598028  -32.985135    9.896025     2  7522
7525  7524  H      0.585923  -33.132777    8.389390     2  7522
7526  7525  O    -13.973845   30.636235    6.795394     1  7526  7527
7527  7526  H    -14.160740   31.549908    6.579750     2  7525
7528  7527  H    -13.180003   30.673128    7.328954     2  7525
7529  7528  O     -4.954736   33.056016   10.955145     1  7529  7530
7530  7529  H     -5.015106   33.996414   11.123191     2  7528
7531  7530  H     -5.862473   32.773296   10.844178     2  7528
7532  7531  O    -18.355243   -1.763999   14.705792     1  7532  7533
7533  7532  H    -18.089634   -2.658584   14.492715     2  7531
7534  7533  H    -19.074927   -1.869113   15.328077     2  7531
7535  7534  O     -4.288287   12.212631   33.791904     1  7535  7536
7536  7535  H     -3.650768   11.686864   34.274987     2  7534
7537  7536  H     -4.956991   12.434164   34.439970     2  7534
7538  7537  O     -9.124363   29.590598   13.764691     1  7538  7539
7539  7538  H     -9.474959   29.304558   14.608192     2  7537
7540  7539  H     -9.897016   29.825842   13.250980     2  7537
7541  7540  O    -19.371680   -4.812050    4.913041     1  7541  7542
7542  7541  H    -19.151905   -5.279990    4.107460     2  7540
7543  7542  H    -20.190740   -5.211089    5.206536     2  7540
7544  7543  O    -35.568254  -14.216915   -1.715058     1  7544  7545
7545  7544  H    -36.095939  -14.685499   -1.068367     2  7543
7546  7545  H    -35.115225  -14.906514   -2.200290     2  7543
7547  7546  O     -0.333967   -0.022378   11.956854     1  7547  7548
7548  7547  H      0.392797   -0.631924   11.828404     2  7546
7549  7548  H     -0.812992   -0.374722   12.706934     2  7546
7550  7549  O    -17.704785    5.263929   10.608223     1  7550  7551
7551  7550  H    -18.418327    5.862337   10.386870     2  7549
7552  7551  H    -17.718044    4.606827    9.912325     2  7549
7553  7552  O    -32.850457    0.383217    9.245789     1  7553  7554
7554  7553  H    -32.292593   -0.392443    9.303842     2  7552
7555  7554  H    -33.067855    0.591030   10.154515     2  7552
7556  7555  O    -19.742718   11.092788    0.504787     1  7556  7557
7557  7556  H    -19.770070   11.988499    0.168356     2  7555
7558  7557  H    -18.849890   10.986963    0.833254     2  7555
7559  7558  O    -23.388578    5.767982   22.259312     1  7559  7560
7560  7559  H    -23.905999    6.093667   21.522809     2  7558
7561  7560  H    -24.038176    5.505392   22.911463     2  7558
7562  7561  O    -11.860527   28.829903    3.808993     1  7562  7563
7563  7562  H    -11.209688   28.638451    4.484260     2  7561
7564  7563  H    -11.682318   29.735047    3.553672     2  7561
7565  7564  O    -14.048627   10.234297   13.740672     1  7565  7566
7566  7565  H    -14.275564    9.419411   14.188659     2  7564
7567  7566  H    -13.367013    9.983591   13.117150     2  7564
7568  7567  O    -15.016467   15.920791   16.488311     1  7568  7569
7569  7568  H    -14.879069   15.271938   17.178487     2  7567
7570  7569  H    -15.646364   15.510872   15.895496     2  7567
7571  7570  O      3.143433   15.171251    8.975201     1  7571  7572
7572  7571  H      2.391621   14.997877    9.541726     2  7570
7573  7572  H      3.232467   16.124292    8.979532     2  7570
7574  7573  O    -30.095241    5.059060    5.273155     1  7574  7575
7575  7574  H    -29.878967    4.629911    6.100976     2  7573
7576  7575  H    -29.564872    4.602233    4.620276     2  7573
7577  7576  O    -17.989154   -2.375803    4.371798     1  7577  7578
7578  7577  H    -18.069271   -2.075831    3.466353     2  7576
7579  7578  H    -18.598637   -3.111100    4.435829     2  7576
7580  7579  O    -24.782136   -0.400826    2.291975     1  7580  7581
7581  7580  H    -25.609490   -0.070360    1.941963     2  7579
7582  7581  H    -25.004243   -1.251757    2.669886     2  7579
7583  7582  O      1.619429   12.460289   16.526078     1  7583  7584
7584  7583  H      0.735127   12.213058   16.255673     2  7582
7585  7584  H      2.024994   11.638025   16.801087     2  7582
7586  7585  O    -18.832443   17.897552   10.652943     1  7586  7587
7587  7586  H    -19.002279   18.832003   10.772059     2  7585
7588  7587  H    -17.958458   17.860098   10.264385     2  7585
7589  7588  O    -10.617916    0.059462   15.331813     1  7589  7590
7590  7589  H    -10.876451    0.570749   16.098609     2  7588
7591  7590  H     -9.745732    0.385011   15.109230     2  7588
7592  7591  O    -23.513614   10.534138    8.722931     1  7592  7593
7593  7592  H    -24.317682   10.450392    9.235465     2  7591
7594  7593  H    -23.662255    9.986504    7.952065     2  7591
7595  7594  O     11.074132  -25.985092  -16.797324     1  7595  7596
7596  7595  H     10.213023  -26.129975  -16.405237     2  7594
7597  7596  H     11.077771  -25.057199  -17.032340     2  7594
7598  7597  O      9.405494  -35.094668   -9.882848     1  7598  7599
7599  7598  H      8.642921  -34.527094   -9.994977     2  7597
7600  7599  H      9.683693  -35.301873  -10.774982     2  7597
7601  7600  O     -7.676321   25.849458   -0.889837     1  7601  7602
7602  7601  H     -8.400237   26.029544   -0.290048     2  7600
7603  7602  H     -7.576536   26.656532   -1.394720     2  7600
7604  7603  O      6.629320  -13.148087  -28.293335     1  7604  7605
7605  7604  H      7.179207  -12.629237  -28.880404     2  7603
7606  7605  H      6.773065  -14.053750  -28.567823     2  7603
7607  7606  O     -4.220165    0.143179   35.823998     1  7607  7608
7608  7607  H     -3.569921   -0.025211   35.142045     2  7606
7609  7608  H     -5.062895    0.061160   35.377555     2  7606
7610  7609  O    -30.432971   18.393125    3.361648     1  7610  7611
7611  7610  H    -29.925668   18.244408    2.563677     2  7609
7612  7611  H    -30.685810   19.315245    3.316928     2  7609
7613  7612  O      3.768192  -29.359002  -19.573139     1  7613  7614
7614  7613  H      3.237070  -29.489435  -18.787564     2  7612
7615  7614  H      4.507592  -29.957181  -19.464972     2  7612
7616  7615  O      1.223244   14.648555  -30.873601     1  7616  7617
7617  7616  H      1.221544   13.755256  -31.217469     2  7615
7618  7617  H      0.519095   14.657484  -30.225277     2  7615
7619  7618  O     -3.905707    4.550289   33.221242     1  7619  7620
7620  7619  H     -3.777057    3.747113   32.716675     2  7618
7621  7620  H     -3.237942    4.513064   33.906031     2  7618
7622  7621  O    -11.703251   24.635277   14.087202     1  7622  7623
7623  7622  H    -11.708951   23.730635   14.399968     2  7621
7624  7623  H    -12.224735   25.114991   14.730755     2  7621
7625  7624  O     -3.922077   19.637816   19.318479     1  7625  7626
7626  7625  H     -3.388598   18.844820   19.371289     2  7624
7627  7626  H     -4.099280   19.746060   18.384074     2  7624
7628  7627  O     -5.327203  -34.582786   10.278108     1  7628  7629
7629  7628  H     -4.973168  -33.990608    9.614620     2  7627
7630  7629  H     -6.082099  -34.116729   10.637489     2  7627
7631  7630  O    -20.924582    0.521502   12.095722     1  7631  7632
7632  7631  H    -21.076908    1.384115   11.709813     2  7630
7633  7632  H    -21.211061    0.611230   13.004629     2  7630
7634  7633  O     25.645271  -19.637056   -7.077302     1  7634  7635
7635  7634  H     24.986685  -19.789817   -7.754916     2  7633
7636  7635  H     25.485293  -18.739692   -6.785110     2  7633
7637  7636  O     35.620224    2.316309    7.773330     1  7637  7638
7638  7637  H     36.157794    1.524506    7.756067     2  7636
7639  7638  H     36.222649    3.009545    8.043032     2  7636
7640  7639  O      3.116505  -17.426435  -20.341091     1  7640  7641
7641  7640  H      3.868255  -17.666850  -20.882665     2  7639
7642  7641  H      2.575132  -16.880129  -20.910913     2  7639
7643  7642  O     -2.523182    4.173618   35.746543     1  7643  7644
7644  7643  H     -1.828964    3.585368   36.043620     2  7642
7645  7644  H     -2.059906    4.938954   35.406151     2  7642
7646  7645  O      2.045436   17.029899   23.208919     1  7646  7647
7647  7646  H      1.756621   16.635533   24.031897     2  7645
7648  7647  H      1.734679   16.428228   22.532418     2  7645
7649  7648  O    -27.544360   12.284302    4.752415     1  7649  7650
7650  7649  H    -27.196003   11.456600    5.083758     2  7648
7651  7650  H    -27.703175   12.809088    5.537023     2  7648
7652  7651  O    -11.547967   10.621957   11.295832     1  7652  7653
7653  7652  H    -12.452257   10.933819   11.260722     2  7651
7654  7653  H    -11.018185   11.418810   11.271567     2  7651
7655  7654  O     -5.471123   25.808617    6.656263     1  7655  7656
7656  7655  H     -5.124581   26.601623    7.065263     2  7654
7657  7656  H     -5.082515   25.800266    5.781537     2  7654
7658  7657  O    -17.780490   15.334151    7.336369     1  7658  7659
7659  7658  H    -17.492900   15.646515    6.478492     2  7657
7660  7659  H    -17.055747   15.546596    7.924456     2  7657
7661  7660  O     -1.309369   12.920976    3.724751     1  7661  7662
7662  7661  H     -0.876964   12.081285    3.569262     2  7660
7663  7662  H     -0.886844   13.525171    3.114298     2  7660
7664  7663  O    -21.080864   15.221236   12.893066     1  7664  7665
7665  7664  H    -21.150278   16.049080   13.368552     2  7663
7666  7665  H    -21.690621   14.635155   13.341327     2  7663
7667  7666  O     -6.425310   29.204084   -0.920203     1  7667  7668
7668  7667  H     -6.273090   28.595658   -1.643306     2  7666
7669  7668  H     -5.680765   29.070750   -0.333599     2  7666
7670  7669  O      2.626491   32.314331    4.051518     1  7670  7671
7671  7670  H      3.248235   32.030597    4.721712     2  7669
7672  7671  H      3.119986   32.270771    3.232496     2  7669
7673  7672  O    -13.826938   13.125278   15.215207     1  7673  7674
7674  7673  H    -14.704259   13.007580   14.850945     2  7672
7675  7674  H    -13.801390   12.541117   15.973056     2  7672
7676  7675  O     -8.913720   12.703323   15.326706     1  7676  7677
7677  7676  H     -9.184734   13.600515   15.521203     2  7675
7678  7677  H     -9.679164   12.306120   14.911306     2  7675
7679  7678  O     -6.703301    2.294184   10.093487     1  7679  7680
7680  7679  H     -6.726282    1.971449    9.192628     2  7678
7681  7680  H     -7.521680    2.780111   10.195276     2  7678
7682  7681  O     -8.631754   20.008123   19.989351     1  7682  7683
7683  7682  H     -9.586760   20.070277   20.007588     2  7681
7684  7683  H     -8.445155   19.385522   19.286655     2  7681
7685  7684  O      3.776105    7.774021   23.706669     1  7685  7686
7686  7685  H      2.988769    7.257515   23.878585     2  7684
7687  7686  H      3.642813    8.129484   22.827971     2  7684
7688  7687  O    -13.236959   27.740280   -5.206043     1  7688  7689
7689  7688  H    -12.592741   28.289021   -4.758720     2  7687
7690  7689  H    -12.900981   27.654514   -6.098229     2  7687
7691  7690  O    -26.382986    6.714539   11.518023     1  7691  7692
7692  7691  H    -26.299269    5.762406   11.466407     2  7690
7693  7692  H    -26.271989    7.014472   10.615831     2  7690
7694  7693  O     -9.490653   10.582540   29.074306     1  7694  7695
7695  7694  H     -8.693040   10.139359   28.785107     2  7693
7696  7695  H     -9.524417   11.382453   28.549680     2  7693
7697  7696  O    -10.008955   -1.691994   11.384735     1  7697  7698
7698  7697  H     -9.145550   -1.290035   11.480609     2  7696
7699  7698  H    -10.457573   -1.496043   12.207279     2  7696
7700  7699  O     -9.771255   29.702975    7.363960     1  7700  7701
7701  7700  H     -9.846484   28.833360    6.971096     2  7699
7702  7701  H     -9.308190   30.223583    6.707629     2  7699
7703  7702  O    -20.168201   -5.221067   12.401726     1  7703  7704
7704  7703  H    -19.423043   -4.859887   12.881852     2  7702
7705  7704  H    -20.549792   -4.468661   11.949502     2  7702
7706  7705  O    -17.380124    1.556988    0.946588     1  7706  7707
7707  7706  H    -16.892851    2.258775    0.514973     2  7705
7708  7707  H    -18.083895    2.006212    1.414707     2  7705
7709  7708  O    -12.595270   15.651925    8.566436     1  7709  7710
7710  7709  H    -12.001760   14.901250    8.587992     2  7708
7711  7710  H    -12.210351   16.279825    9.177837     2  7708
7712  7711  O     -5.989336   19.791851   21.335044     1  7712  7713
7713  7712  H     -6.718466   20.017549   20.757410     2  7711
7714  7713  H     -5.208591   19.913780   20.794857     2  7711
7715  7714  O     -7.034460   10.385405    7.663452     1  7715  7716
7716  7715  H     -6.448952    9.931755    8.269764     2  7714
7717  7716  H     -6.476127   10.622951    6.923137     2  7714
7718  7717  O    -22.206532   11.531182    1.987772     1  7718  7719
7719  7718  H    -21.303057   11.314350    1.757670     2  7717
7720  7719  H    -22.706466   11.352818    1.191227     2  7717
7721  7720  O     -5.418101   11.447274   12.279594     1  7721  7722
7722  7721  H     -6.177921   11.974163   12.032019     2  7720
7723  7722  H     -5.652440   11.072242   13.128515     2  7720
7724  7723  O      0.224015   18.358249   19.724435     1  7724  7725
7725  7724  H      0.798092   19.117057   19.828726     2  7723
7726  7725  H      0.813100   17.604713   19.761771     2  7723
7727  7726  O    -19.127551   16.863157   17.508080     1  7727  7728
7728  7727  H    -20.013684   16.725487   17.173347     2  7726
7729  7728  H    -18.555690   16.518379   16.822270     2  7726
7730  7729  O     -6.416070   13.171064   16.226603     1  7730  7731
7731  7730  H     -7.184495   13.102817   15.659949     2  7729
7732  7731  H     -6.529153   14.003685   16.685062     2  7729
7733  7732  O     -3.093786   21.160549   13.324393     1  7733  7734
7734  7733  H     -3.212324   21.123407   12.375288     2  7732
7735  7734  H     -3.972394   21.030435   13.681254     2  7732
7736  7735  O     -4.055185    8.464637   30.006485     1  7736  7737
7737  7736  H     -4.947611    8.771291   30.167018     2  7735
7738  7737  H     -3.509350    9.004970   30.577742     2  7735
7739  7738  O     15.892252  -12.164009  -23.029759     1  7739  7740
7740  7739  H     16.199724  -11.384755  -23.492852     2  7738
7741  7740  H     16.432326  -12.875870  -23.372988     2  7738
7742  7741  O     -9.964417    3.951727   15.717925     1  7742  7743
7743  7742  H     -9.498956    4.468643   16.375478     2  7741
7744  7743  H     -9.350665    3.256596   15.480577     2  7741
7745  7744  O     -0.317481    7.210518   32.537238     1  7745  7746
7746  7745  H      0.401041    7.378066   31.927413     2  7744
7747  7746  H     -0.909100    7.953979   32.421123     2  7744
7748  7747  O      2.447042   14.018768   32.315087     1  7748  7749
7749  7748  H      3.043772   13.316095   32.572763     2  7747
7750  7749  H      2.970348   14.580414   31.743303     2  7747
7751  7750  O      3.158869  -19.269863  -24.774899     1  7751  7752
7752  7751  H      4.065594  -18.964649  -24.805304     2  7750
7753  7752  H      3.206676  -20.121197  -24.339955     2  7750
7754  7753  O    -10.248294    2.082615   11.376584     1  7754  7755
7755  7754  H     -9.977117    2.906047   11.782361     2  7753
7756  7755  H    -10.898286    1.720852   11.978971     2  7753
7757  7756  O     23.430684  -24.918525   -5.466733     1  7757  7758
7758  7757  H     23.785475  -24.057071   -5.247069     2  7756
7759  7758  H     24.171009  -25.516425   -5.363456     2  7756
7760  7759  O    -10.798067   12.017110    2.549940     1  7760  7761
7761  7760  H    -10.502554   11.774416    1.672442     2  7759
7762  7761  H    -11.749463   11.916460    2.519163     2  7759
7763  7762  O     -2.730192   27.411702    4.570470     1  7763  7764
7764  7763  H     -3.433783   27.531214    3.932577     2  7762
7765  7764  H     -2.646648   28.263977    4.998116     2  7762
7766  7765  O    -15.592021    9.371058   16.597720     1  7766  7767
7767  7766  H    -15.004616    9.871859   17.163746     2  7765
7768  7767  H    -15.022069    8.739076   16.159557     2  7765
7769  7768  O    -29.659093   10.069057   -1.735034     1  7769  7770
7770  7769  H    -30.088113   10.312696   -0.914783     2  7768
7771  7770  H    -29.510145    9.126719   -1.657283     2  7768
7772  7771  O    -27.450998    0.760340   12.598762     1  7772  7773
7773  7772  H    -27.304709    0.747570   13.544631     2  7771
7774  7773  H    -26.646596    1.131742   12.236504     2  7771
7775  7774  O    -25.210739    0.046723   15.225348     1  7775  7776
7776  7775  H    -25.901780    0.695827   15.357102     2  7774
7777  7776  H    -24.535045    0.283201   15.860759     2  7774
7778  7777  O     34.772017  -14.303290    3.236178     1  7778  7779
7779  7778  H     34.628014  -13.538209    3.793086     2  7777
7780  7779  H     33.950311  -14.792034    3.282659     2  7777
7781  7780  O    -25.689036    8.961470   15.787637     1  7781  7782
7782  7781  H    -25.846281    8.882265   14.846769     2  7780
7783  7782  H    -24.759511    8.758959   15.893489     2  7780
7784  7783  O     -3.348971   20.788885   16.620878     1  7784  7785
7785  7784  H     -2.541195   20.295441   16.763156     2  7783
7786  7785  H     -3.430764   20.846032   15.668893     2  7783
7787  7786  O    -29.000701    7.517854   14.822581     1  7787  7788
7788  7787  H    -29.939697    7.628212   14.972041     2  7786
7789  7788  H    -28.645586    8.405917   14.860924     2  7786
7790  7789  O    -20.085639    5.565310   21.007074     1  7790  7791
7791  7790  H    -19.775740    5.894196   20.163256     2  7789
7792  7791  H    -21.039469    5.560139   20.926991     2  7789
7793  7792  O     -2.474166    5.204198   14.679813     1  7793  7794
7794  7793  H     -2.235492    6.095459   14.425017     2  7792
7795  7794  H     -2.222282    5.142413   15.601208     2  7792
7796  7795  O      5.758527  -17.489583  -25.734625     1  7796  7797
7797  7796  H      6.495728  -16.880139  -25.771279     2  7795
7798  7797  H      5.836617  -17.909448  -24.877977     2  7795
7799  7798  O      3.307243   20.814571   22.678021     1  7799  7800
7800  7799  H      3.825920   20.071533   22.986404     2  7798
7801  7800  H      3.900407   21.563307   22.739511     2  7798
7802  7801  O     -5.193108    9.656877   34.784413     1  7802  7803
7803  7802  H     -5.739426    9.377387   35.519024     2  7801
7804  7803  H     -5.054508    8.860487   34.271788     2  7801
7805  7804  O    -23.359085   12.869436   11.412540     1  7805  7806
7806  7805  H    -23.252012   11.936560   11.226778     2  7804
7807  7806  H    -23.042245   13.309155   10.623559     2  7804
7808  7807  O     -1.264124   17.009866   15.460311     1  7808  7809
7809  7808  H     -1.093631   17.569146   16.218183     2  7807
7810  7809  H     -1.390384   17.621075   14.734561     2  7807
7811  7810  O    -25.084362    8.465410   13.231136     1  7811  7812
7812  7811  H    -24.199924    8.122735   13.359876     2  7810
7813  7812  H    -25.575465    7.730344   12.864082     2  7810
7814  7813  O      3.268648   25.269839   14.154270     1  7814  7815
7815  7814  H      4.117891   25.107655   14.565018     2  7813
7816  7815  H      3.284574   24.744140   13.354508     2  7813
7817  7816  O     -3.099189   24.610033   11.432547     1  7817  7818
7818  7817  H     -3.127075   23.653239   11.432151     2  7816
7819  7818  H     -2.167736   24.822999   11.375343     2  7816
7820  7819  O    -27.867592   14.155200    6.817032     1  7820  7821
7821  7820  H    -27.184647   14.261989    7.479160     2  7819
7822  7821  H    -27.893952   14.996681    6.361570     2  7819
7823  7822  O    -35.999661   10.656133    4.705727     1  7823  7824
7824  7823  H    -36.578125   11.083964    4.074402     2  7822
7825  7824  H    -35.759925    9.828421    4.289009     2  7822
7826  7825  O    -29.959495    1.840843   12.107335     1  7826  7827
7827  7826  H    -29.854241    2.520513   12.773069     2  7825
7828  7827  H    -29.140298    1.346628   12.137321     2  7825
7829  7828  O    -27.788351    5.890622    1.760890     1  7829  7830
7830  7829  H    -27.411873    6.584708    2.301945     2  7828
7831  7830  H    -28.733030    6.038983    1.803325     2  7828
7832  7831  O    -24.251610   16.926351   11.389656     1  7832  7833
7833  7832  H    -25.123052   17.198074   11.101583     2  7831
7834  7833  H    -23.839848   16.567927   10.603388     2  7831
7835  7834  O    -20.924373    8.728583   19.096798     1  7835  7836
7836  7835  H    -20.477569    9.050701   19.879638     2  7834
7837  7836  H    -21.234174    7.855956   19.339241     2  7834
7838  7837  O    -15.266938    8.766133    6.016993     1  7838  7839
7839  7838  H    -15.742769    8.249048    6.666947     2  7837
7840  7839  H    -14.485006    8.248725    5.824374     2  7837
7841  7840  O     -7.670510   13.017686    8.414542     1  7841  7842
7842  7841  H     -7.432741   13.815295    7.941766     2  7840
7843  7842  H     -7.169707   12.325010    7.983698     2  7840
7844  7843  O     -1.520731   12.101827   30.442061     1  7844  7845
7845  7844  H     -1.749144   13.020437   30.584236     2  7843
7846  7845  H     -1.956961   11.870191   29.622134     2  7843
7847  7846  O     -9.457829    6.835017   25.732685     1  7847  7848
7848  7847  H     -9.847450    7.178408   26.536744     2  7846
7849  7848  H     -8.996473    6.043081   26.008763     2  7846
7850  7849  O    -12.140124   13.926595   22.238726     1  7850  7851
7851  7850  H    -11.510095   13.520457   21.643456     2  7849
7852  7851  H    -12.816950   13.261116   22.362321     2  7849
7853  7852  O      0.732868  -18.067085  -25.409775     1  7853  7854
7854  7853  H      0.091823  -18.554375  -24.892241     2  7852
7855  7854  H      1.571703  -18.478849  -25.202316     2  7852
7856  7855  O     -0.677877   21.369842   22.205900     1  7856  7857
7857  7856  H     -0.072741   22.032394   22.539166     2  7855
7858  7857  H     -0.490347   20.589473   22.727520     2  7855
7859  7858  O    -21.979612    3.628388   19.804124     1  7859  7860
7860  7859  H    -21.128106    3.598550   20.240334     2  7858
7861  7860  H    -21.853218    3.130080   18.996693     2  7858
7862  7861  O      1.370953  -22.409590  -29.402722     1  7862  7863
7863  7862  H      0.688956  -22.863806  -28.907951     2  7861
7864  7863  H      2.001937  -22.129161  -28.739812     2  7861
7865  7864  O    -18.121454    0.103183   11.144740     1  7865  7866
7866  7865  H    -18.924261    0.326896   11.615575     2  7864
7867  7866  H    -17.542338    0.851607   11.288677     2  7864
7868  7867  O     -4.010308   34.434915    1.403331     1  7868  7869
7869  7868  H     -3.411528   33.853541    0.934611     2  7867
7870  7869  H     -3.876664   34.222888    2.327136     2  7867
7871  7870  O    -23.887382    4.311538   24.829926     1  7871  7872
7872  7871  H    -23.589761    3.413719   24.683045     2  7870
7873  7872  H    -23.107332    4.776468   25.132570     2  7870
7874  7873  O    -32.066131    8.014861   14.221393     1  7874  7875
7875  7874  H    -32.463532    7.690069   15.029362     2  7873
7876  7875  H    -32.225677    8.958526   14.237947     2  7873
7877  7876  O    -21.456922    8.095307    0.585585     1  7877  7878
7878  7877  H    -21.481847    8.409822   -0.318125     2  7876
7879  7878  H    -21.164457    8.851221    1.094789     2  7876
7880  7879  O     -3.862282   27.953077   10.657913     1  7880  7881
7881  7880  H     -4.070981   27.689808   11.554220     2  7879
7882  7881  H     -4.059005   28.889453   10.630854     2  7879
7883  7882  O      9.529356  -30.253514  -13.977953     1  7883  7884
7884  7883  H      9.140629  -31.121205  -14.088563     2  7882
7885  7884  H      9.108657  -29.714868  -14.648106     2  7882
7886  7885  O     -6.285834   19.022013   16.159773     1  7886  7887
7887  7886  H     -5.817692   18.416633   15.584804     2  7885
7888  7887  H     -5.988779   19.890142   15.887117     2  7885
7889  7888  O     -3.780987   16.466660   24.360251     1  7889  7890
7890  7889  H     -3.549666   15.805573   25.012697     2  7888
7891  7890  H     -3.835290   17.283956   24.855540     2  7888
7892  7891  O     -8.666479   -1.833264    6.371894     1  7892  7893
7893  7892  H     -8.534582   -1.908716    5.426832     2  7891
7894  7893  H     -9.171685   -1.027483    6.480123     2  7891
7895  7894  O     -5.473589    8.635895   25.856673     1  7895  7896
7896  7895  H     -5.919075    9.176396   25.204266     2  7894
7897  7896  H     -5.661530    9.064100   26.691867     2  7894
7898  7897  O      0.023043    3.871280    8.276552     1  7898  7899
7899  7898  H     -0.423405    4.613863    7.869751     2  7897
7900  7899  H      0.162756    4.142890    9.183712     2  7897
7901  7900  O    -11.049329  -33.857424    6.395953     1  7901  7902
7902  7901  H    -11.437014  -34.731746    6.357285     2  7900
7903  7902  H    -10.854800  -33.721958    7.323335     2  7900
7904  7903  O     26.839429    3.041477  -22.928300     1  7904  7905
7905  7904  H     26.009862    2.565269  -22.892595     2  7903
7906  7905  H     26.945181    3.405540  -22.049376     2  7903
7907  7906  O     -4.310552   -1.915215    6.346603     1  7907  7908
7908  7907  H     -4.223994   -1.031561    6.704228     2  7906
7909  7908  H     -4.104810   -2.492810    7.081644     2  7906
7910  7909  O     24.425403  -19.762765   -9.519208     1  7910  7911
7911  7910  H     24.635257  -18.853671   -9.733079     2  7909
7912  7911  H     24.184610  -20.157086  -10.357517     2  7909
7913  7912  O     -6.456528    9.977365   23.728839     1  7913  7914
7914  7913  H     -7.333789   10.216243   23.429535     2  7912
7915  7914  H     -6.044168    9.573393   22.965295     2  7912
7916  7915  O    -18.487987    1.981176   14.574900     1  7916  7917
7917  7916  H    -18.912340    2.748388   14.959012     2  7915
7918  7917  H    -18.748247    1.254437   15.140893     2  7915
7919  7918  O    -26.555611   -4.903360   13.986651     1  7919  7920
7920  7919  H    -26.694320   -3.961204   14.083261     2  7918
7921  7920  H    -27.101840   -5.151103   13.240670     2  7918
7922  7921  O      0.238829   27.351769    6.936056     1  7922  7923
7923  7922  H      0.471990   26.914045    6.117359     2  7921
7924  7923  H      0.494502   28.264331    6.801547     2  7921
7925  7924  O     -4.887724    4.290511   22.075563     1  7925  7926
7926  7925  H     -4.170513    3.956639   22.614422     2  7924
7927  7926  H     -5.405632    4.830110   22.672920     2  7924
7928  7927  O     -2.119882    1.234691   27.632810     1  7928  7929
7929  7928  H     -2.865581    0.645711   27.517624     2  7927
7930  7929  H     -2.433451    1.902434   28.242749     2  7927
7931  7930  O    -30.241233   10.682540    1.508077     1  7931  7932
7932  7931  H    -30.343973   11.470564    2.041645     2  7930
7933  7932  H    -30.786111   10.026089    1.942142     2  7930
7934  7933  O     -7.512115   27.415274   16.619758     1  7934  7935
7935  7934  H     -6.971163   26.685655   16.921850     2  7933
7936  7935  H     -8.018195   27.053661   15.892194     2  7933
7937  7936  O    -12.395337    0.475846   35.358201     1  7937  7938
7938  7937  H    -11.629690    0.112550   34.913194     2  7936
7939  7938  H    -12.129741    0.544605   36.275241     2  7936
7940  7939  O     -1.646176   15.080948   18.418172     1  7940  7941
7941  7940  H     -2.050347   15.070385   17.550551     2  7939
7942  7941  H     -2.125032   14.416876   18.914092     2  7939
7943  7942  O     -8.672707    4.704507    9.991684     1  7943  7944
7944  7943  H     -9.392985    4.866797    9.382508     2  7942
7945  7944  H     -9.083659    4.710070   10.856160     2  7942
7946  7945  O     -9.901327    4.437135   20.087664     1  7946  7947
7947  7946  H     -9.588388    4.527797   19.187619     2  7945
7948  7947  H     -9.512780    3.618296   20.395504     2  7945
7949  7948  O     28.118733  -19.978294   -0.733305     1  7949  7950
7950  7949  H     28.667939  -20.037234   -1.515053     2  7948
7951  7950  H     27.710733  -19.114342   -0.791229     2  7948
7952  7951  O    -26.017898    1.540811    7.599909     1  7952  7953
7953  7952  H    -26.912580    1.564871    7.939316     2  7951
7954  7953  H    -25.530459    2.139726    8.165538     2  7951
7955  7954  O      5.852997  -20.110247  -20.837333     1  7955  7956
7956  7955  H      6.669962  -20.598441  -20.735033     2  7954
7957  7956  H      5.697587  -19.719581  -19.977414     2  7954
7958  7957  O    -24.307974    8.861921    6.727668     1  7958  7959
7959  7958  H    -24.513754    7.936880    6.592812     2  7957
7960  7959  H    -24.118740    9.195983    5.850841     2  7957
7961  7960  O    -22.383863   20.670734   10.415756     1  7961  7962
7962  7961  H    -23.059515   21.342838   10.505209     2  7960
7963  7962  H    -22.101728   20.734018    9.503273     2  7960
7964  7963  O    -30.236939    6.652970    1.989312     1  7964  7965
7965  7964  H    -30.423748    7.363535    2.602853     2  7963
7966  7965  H    -30.836149    5.951592    2.244749     2  7963
7967  7966  O     -8.829848   10.808746   17.997198     1  7967  7968
7968  7967  H     -9.519026   11.071586   17.387132     2  7966
7969  7968  H     -8.503842   11.632240   18.360252     2  7966
7970  7969  O     -4.810016    7.665182   17.693709     1  7970  7971
7971  7970  H     -5.468381    8.327451   17.903915     2  7969
7972  7971  H     -4.016935    7.965915   18.137346     2  7969
7973  7972  O    -12.414212   19.090539    4.845465     1  7973  7974
7974  7973  H    -12.623851   18.261738    4.414918     2  7972
7975  7974  H    -13.231819   19.355685    5.266710     2  7972
7976  7975  O     -3.745349    2.726734   23.979996     1  7976  7977
7977  7976  H     -2.908458    2.341985   24.240406     2  7975
7978  7977  H     -4.086284    3.124436   24.781137     2  7975
7979  7978  O    -20.122699    6.968005    9.256578     1  7979  7980
7980  7979  H    -19.767335    7.454423    8.512706     2  7978
7981  7980  H    -21.060403    7.159718    9.242788     2  7978
7982  7981  O     -5.089845    8.647435   21.872508     1  7982  7983
7983  7982  H     -4.264515    9.128042   21.808639     2  7981
7984  7983  H     -5.363956    8.519502   20.964362     2  7981
7985  7984  O    -13.311838    5.733384   10.167422     1  7985  7986
7986  7985  H    -12.485874    5.622791    9.696483     2  7984
7987  7986  H    -13.381591    4.952294   10.716297     2  7984
7988  7987  O    -13.750390    4.189743   12.519647     1  7988  7989
7989  7988  H    -13.873992    3.584498   13.250833     2  7987
7990  7989  H    -13.210716    4.893699   12.879411     2  7987
7991  7990  O     -7.280861   18.971570   10.901869     1  7991  7992
7992  7991  H     -7.819483   18.400894   11.449999     2  7990
7993  7992  H     -7.879344   19.289829   10.226027     2  7990
7994  7993  O     33.921397    1.923487   17.191125     1  7994  7995
7995  7994  H     34.657653    2.528073   17.284044     2  7993
7996  7995  H     34.266860    1.078558   17.479188     2  7993
7997  7996  O     -8.566974    5.719667    5.021583     1  7997  7998
7998  7997  H     -9.340246    5.182277    5.193321     2  7996
7999  7998  H     -7.850209    5.253146    5.451510     2  7996
8000  7999  O     -6.445434   -1.603530   13.918917     1  8000  8001
8001  8000  H     -6.637892   -2.471713   13.564730     2  7999
8002  8001  H     -7.045772   -1.507470   14.658239     2  7999
8003  8002  O    -24.982969   15.014327   14.331994     1  8003  8004
8004  8003  H    -24.572598   15.798109   13.966600     2  8002
8005  8004  H    -25.921620   15.199809   14.304349     2  8002
8006  8005  O    -10.910840    7.632651   28.185477     1  8006  8007
8007  8006  H    -11.841352    7.432534   28.083829     2  8005
8008  8007  H    -10.894671    8.469421   28.650004     2  8005
8009  8008  O     -5.065723    1.924107   28.825087     1  8009  8010
8010  8009  H     -4.343533    2.497185   29.082484     2  8008
8011  8010  H     -4.661449    1.063577   28.714257     2  8008
8012  8011  O      1.063637   29.742451    6.087701     1  8012  8013
8013  8012  H      1.828076   29.943108    5.547701     2  8011
8014  8013  H      1.081505   30.400258    6.782829     2  8011
8015  8014  O     -1.524840   13.553347   34.622472     1  8015  8016
8016  8015  H     -1.859935   12.658171   34.673477     2  8014
8017  8016  H     -1.257263   13.760812   35.517789     2  8014
8018  8017  O     -2.163442   12.324475    9.457438     1  8018  8019
8019  8018  H     -1.469965   12.941483    9.223723     2  8017
8020  8019  H     -2.019245   11.572508    8.882995     2  8017
8021  8020  O    -12.538911    7.409825   24.908065     1  8021  8022
8022  8021  H    -11.610680    7.527484   25.109997     2  8020
8023  8022  H    -12.923828    8.277047   25.034544     2  8020
8024  8023  O      0.007885   10.951618   11.136938     1  8024  8025
8025  8024  H      0.738974   10.355833   11.300585     2  8023
8026  8025  H      0.213115   11.730906   11.653486     2  8023
8027  8026  O    -15.376549   -2.508235    8.648425     1  8027  8028
8028  8027  H    -15.430236   -2.366595    9.593564     2  8026
8029  8028  H    -15.512459   -1.640620    8.267633     2  8026
8030  8029  O    -15.615507   14.428529    3.525709     1  8030  8031
8031  8030  H    -14.911185   13.781864    3.481127     2  8029
8032  8031  H    -16.363123   13.945236    3.877461     2  8029
8033  8032  O    -15.937491    6.204485   12.421671     1  8033  8034
8034  8033  H    -16.555438    5.914121   11.750804     2  8032
8035  8034  H    -15.149548    5.684578   12.263326     2  8032
8036  8035  O     -5.350293    5.090809    3.454738     1  8036  8037
8037  8036  H     -5.882240    4.364012    3.130653     2  8035
8038  8037  H     -5.524455    5.114781    4.395655     2  8035
8039  8038  O     -6.217721    4.310697    6.033128     1  8039  8040
8040  8039  H     -5.337726    4.298335    6.409541     2  8038
8041  8040  H     -6.308305    3.458564    5.606637     2  8038
8042  8041  O     -2.771104   14.376291   31.120533     1  8042  8043
8043  8042  H     -3.524030   14.805698   31.526665     2  8041
8044  8043  H     -2.213102   15.096759   30.827633     2  8041
8045  8044  O     -7.432211    4.830646   25.998465     1  8045  8046
8046  8045  H     -6.616373    5.287850   25.794495     2  8044
8047  8046  H     -7.194500    3.903433   25.997119     2  8044
8048  8047  O     -5.849196    5.558024   16.394010     1  8048  8049
8049  8048  H     -5.052311    5.135211   16.073954     2  8047
8050  8049  H     -5.535739    6.267908   16.954404     2  8047
8051  8050  O     -8.185020   13.854948   21.805469     1  8051  8052
8052  8051  H     -8.442933   14.690252   21.415622     2  8050
8053  8052  H     -8.620687   13.843164   22.657693     2  8050
8054  8053  O    -20.907973   10.320448    9.036145     1  8054  8055
8055  8054  H    -21.824282   10.465884    8.800652     2  8053
8056  8055  H    -20.927414   10.140390    9.976056     2  8053
8057  8056  O     -5.705740   15.536705   12.324154     1  8057  8058
8058  8057  H     -6.073271   14.875399   11.737787     2  8056
8059  8058  H     -4.785656   15.599952   12.067882     2  8056
8060  8059  O     -0.944506    8.686542    9.900799     1  8060  8061
8061  8060  H     -1.421398    9.110464    9.187290     2  8059
8062  8061  H     -0.427421    9.389218   10.294629     2  8059
8063  8062  O    -14.850706   -1.614892   13.938848     1  8063  8064
8064  8063  H    -14.227481   -1.362162   14.619987     2  8062
8065  8064  H    -15.586663   -1.013357   14.051784     2  8062
8066  8065  O    -11.114614    9.279607   30.959731     1  8066  8067
8067  8066  H    -11.032707    9.625622   31.848436     2  8065
8068  8067  H    -10.363839    9.643365   30.490424     2  8065
8069  8068  O      2.230982  -31.780772   13.752342     1  8069  8070
8070  8069  H      1.794135  -31.946209   14.587822     2  8068
8071  8070  H      3.159065  -31.711926   13.976290     2  8068
8072  8071  O    -10.281824   19.940830   11.369834     1  8072  8073
8073  8072  H    -10.901696   19.834256   10.648286     2  8071
8074  8073  H    -10.315489   20.874232   11.579256     2  8071
8075  8074  O     -7.658776   15.432042    3.915521     1  8075  8076
8076  8075  H     -6.866058   15.603770    3.407250     2  8074
8077  8076  H     -7.784175   14.485220    3.851999     2  8074
8078  8077  O     -8.867081   -0.129551   18.430972     1  8078  8079
8079  8078  H     -9.129856   -0.371773   19.318953     2  8077
8080  8079  H     -9.416622    0.623886   18.215176     2  8077
8081  8080  O    -22.030447    2.819326   17.047165     1  8081  8082
8082  8081  H    -21.752061    3.675131   16.721080     2  8080
8083  8082  H    -21.649226    2.192599   16.432253     2  8080
8084  8083  O     -8.370647    1.265905   22.395881     1  8084  8085
8085  8084  H     -7.624347    0.816710   21.999028     2  8083
8086  8085  H     -8.208733    2.194317   22.228347     2  8083
8087  8086  O     -8.922558   -5.449591    8.865786     1  8087  8088
8088  8087  H     -8.412256   -5.016203    8.181681     2  8086
8089  8088  H     -9.146997   -6.302525    8.493815     2  8086
8090  8089  O    -34.867576    4.950253   12.676368     1  8090  8091
8091  8090  H    -35.801152    5.078127   12.508091     2  8089
8092  8091  H    -34.519780    4.608854   11.852526     2  8089
8093  8092  O    -17.643738    1.572407   33.529245     1  8093  8094
8094  8093  H    -17.595354    1.823228   34.451731     2  8092
8095  8094  H    -17.960391    0.669197   33.542415     2  8092
8096  8095  O     -6.436787   -1.065326   28.887839     1  8096  8097
8097  8096  H     -7.390660   -1.126665   28.938771     2  8095
8098  8097  H     -6.137124   -1.974382   28.894986     2  8095
8099  8098  O     -8.374594    5.414002   17.651248     1  8099  8100
8100  8099  H     -8.549594    6.286697   18.003398     2  8098
8101  8100  H     -7.599365    5.528072   17.101486     2  8098
8102  8101  O    -10.823553   13.348170    7.275502     1  8102  8103
8103  8102  H    -10.261287   14.040945    6.928872     2  8101
8104  8103  H    -10.215963   12.663695    7.555790     2  8101
8105  8104  O     16.422174  -33.028746    1.135571     1  8105  8106
8106  8105  H     17.094807  -32.868600    1.797500     2  8104
8107  8106  H     15.644416  -33.272001    1.637717     2  8104
8108  8107  O     12.534957  -29.359239   -2.149100     1  8108  8109
8109  8108  H     12.084419  -28.914104   -2.866806     2  8107
8110  8109  H     13.465353  -29.227136   -2.331151     2  8107
8111  8110  O      0.765272   10.976438    3.269412     1  8111  8112
8112  8111  H      1.111685   11.208600    2.407826     2  8110
8113  8112  H      1.524895   10.654353    3.754660     2  8110
8114  8113  O      1.532106   29.746155   15.578806     1  8114  8115
8115  8114  H      0.889136   29.878022   14.882077     2  8113
8116  8115  H      2.310184   29.417708   15.128306     2  8113
8117  8116  O    -10.500592   26.510419    0.245094     1  8117  8118
8118  8117  H    -10.414040   27.356723   -0.193667     2  8116
8119  8118  H    -10.256700   26.685276    1.154035     2  8116
8120  8119  O     -7.504472    3.917607   21.582944     1  8120  8121
8121  8120  H     -7.992762    4.700156   21.327168     2  8119
8122  8121  H     -6.595743    4.211675   21.645944     2  8119
8123  8122  O      9.746014  -18.557943  -22.422102     1  8123  8124
8124  8123  H      9.687595  -18.650877  -21.471218     2  8122
8125  8124  H      9.730844  -17.612712  -22.572234     2  8122
8126  8125  O     -4.068831    8.949335    6.950993     1  8126  8127
8127  8126  H     -4.711431    9.074585    6.252702     2  8125
8128  8127  H     -4.563463    8.542001    7.662084     2  8125
8129  8128  O     -9.531894   24.175033    2.686726     1  8129  8130
8130  8129  H     -9.364064   23.789974    3.546839     2  8128
8131  8130  H     -9.041285   23.623750    2.077118     2  8128
8132  8131  O      0.329839   15.404261   30.406433     1  8132  8133
8133  8132  H      1.089872   14.952983   30.773760     2  8131
8134  8133  H     -0.104572   14.743071   29.867595     2  8131
8135  8134  O     -7.760757   12.654083    4.162289     1  8135  8136
8136  8135  H     -8.360632   11.951679    3.911271     2  8134
8137  8136  H     -6.891217   12.257438    4.109328     2  8134
8138  8137  O      0.110951   26.586736    2.833804     1  8138  8139
8139  8138  H     -0.016755   26.590910    1.885170     2  8137
8140  8139  H     -0.457699   25.884414    3.149419     2  8137
8141  8140  O    -12.707755   12.253288   -0.880155     1  8141  8142
8142  8141  H    -12.328879   11.449383   -1.235713     2  8140
8143  8142  H    -13.626282   12.224585   -1.147955     2  8140
8144  8143  O    -27.410885   17.277714    2.263426     1  8144  8145
8145  8144  H    -27.098173   16.405179    2.502436     2  8143
8146  8145  H    -26.968066   17.866970    2.874098     2  8143
8147  8146  O     -8.810809    8.170739    8.655062     1  8147  8148
8148  8147  H     -7.870611    8.167273    8.834639     2  8146
8149  8148  H     -8.872688    8.205678    7.700504     2  8146
8150  8149  O     -2.120034    4.814759   17.548005     1  8150  8151
8151  8150  H     -2.098649    5.619237   18.066262     2  8149
8152  8151  H     -1.896026    4.122550   18.170017     2  8149
8153  8152  O    -35.350224    8.173068    3.950861     1  8153  8154
8154  8153  H    -36.150648    7.648137    3.951801     2  8152
8155  8154  H    -34.919519    7.955414    4.777512     2  8152
8156  8155  O    -18.080190    7.695807   13.488474     1  8156  8157
8157  8156  H    -18.841875    7.173607   13.236732     2  8155
8158  8157  H    -17.330884    7.125341   13.317181     2  8155
8159  8158  O     -1.314871    0.126048   31.223527     1  8159  8160
8160  8159  H     -1.886443    0.211227   30.460454     2  8158
8161  8160  H     -0.636268   -0.490018   30.947499     2  8158
8162  8161  O    -15.832027    1.048279   13.823602     1  8162  8163
8163  8162  H    -16.754559    1.261888   13.963382     2  8161
8164  8163  H    -15.363033    1.574719   14.471011     2  8161
8165  8164  O     25.045975  -22.831215   -3.599212     1  8165  8166
8166  8165  H     24.375220  -22.716514   -4.272386     2  8164
8167  8166  H     25.682226  -22.137712   -3.773769     2  8164
8168  8167  O    -12.244183    7.976787   11.730545     1  8168  8169
8169  8168  H    -11.892719    8.808446   11.412664     2  8167
8170  8169  H    -12.148049    7.377147   10.990666     2  8167
8171  8170  O    -18.900149    3.379733   18.509368     1  8171  8172
8172  8171  H    -18.794653    4.208825   18.975960     2  8170
8173  8172  H    -18.924389    3.626108   17.584736     2  8170
8174  8173  O      2.751186   17.984094    9.461451     1  8174  8175
8175  8174  H      1.807313   18.125926    9.389210     2  8173
8176  8175  H      3.138773   18.661580    8.907356     2  8173
8177  8176  O     -8.535470   20.211289    8.846887     1  8177  8178
8178  8177  H     -8.944621   21.006689    8.506055     2  8176
8179  8178  H     -8.940932   19.500884    8.349739     2  8176
8180  8179  O      2.302302    5.745316   10.511802     1  8180  8181
8181  8180  H      1.382422    5.600657   10.733447     2  8179
8182  8181  H      2.754041    4.969499   10.843870     2  8179
8183  8182  O     -7.651482   11.097196   34.607462     1  8183  8184
8184  8183  H     -7.749775   11.365702   33.693967     2  8182
8185  8184  H     -6.706162   11.099150   34.757789     2  8182
8186  8185  O     -5.099709   12.893705    3.761413     1  8186  8187
8187  8186  H     -4.798496   13.411697    4.507863     2  8185
8188  8187  H     -4.866933   13.418550    2.995526     2  8185
8189  8188  O     -9.531072   23.880951   10.188766     1  8189  8190
8190  8189  H     -9.937650   23.192685    9.662254     2  8188
8191  8190  H     -9.154881   24.483381    9.547057     2  8188
8192  8191  O    -18.197821   11.415062   11.866274     1  8192  8193
8193  8192  H    -18.139702   10.466166   11.977854     2  8191
8194  8193  H    -18.160118   11.548083   10.919113     2  8191
8195  8194  O    -15.904545   12.341604   13.282698     1  8195  8196
8196  8195  H    -15.085470   11.852907   13.363459     2  8194
8197  8196  H    -16.581796   11.667431   13.227434     2  8194
8198  8197  O    -16.424163   18.907709    9.195499     1  8198  8199
8199  8198  H    -16.916927   19.489635    8.616900     2  8197
8200  8199  H    -15.642486   18.676146    8.693910     2  8197
8201  8200  O     -1.520221   18.722330   13.364610     1  8201  8202
8202  8201  H     -2.005304   18.508313   12.567665     2  8200
8203  8202  H     -1.709736   19.647672   13.519712     2  8200
8204  8203  O     -8.512738    8.139152    0.353734     1  8204  8205
8205  8204  H     -8.356109    7.321240   -0.118196     2  8203
8206  8205  H     -8.358738    7.919355    1.272540     2  8203
8207  8206  O    -12.527476   15.592887   24.518787     1  8207  8208
8208  8207  H    -12.270596   15.621031   23.597129     2  8206
8209  8208  H    -13.312975   16.137882   24.565740     2  8206
8210  8209  O    -13.596264   11.430256   17.395615     1  8210  8211
8211  8210  H    -13.347332   11.805370   18.240337     2  8209
8212  8211  H    -13.052752   10.646845   17.311392     2  8209
8213  8212  O    -14.889799   -4.492936   13.557802     1  8213  8214
8214  8213  H    -14.348192   -4.677582   12.790469     2  8212
8215  8214  H    -14.924327   -3.537422   13.602872     2  8212
8216  8215  O      6.341592    5.341954   13.900871     1  8216  8217
8217  8216  H      7.168075    5.719920   14.201369     2  8215
8218  8217  H      6.285965    4.498597   14.350188     2  8215
8219  8218  O    -20.321709    4.635267    5.609547     1  8219  8220
8220  8219  H    -20.318265    5.426825    5.071351     2  8218
8221  8220  H    -20.696888    3.961315    5.042749     2  8218
8222  8221  O    -16.637067   21.793879   14.617650     1  8222  8223
8223  8222  H    -17.190255   21.737789   15.396796     2  8221
8224  8223  H    -17.250137   21.746067   13.884103     2  8221
8225  8224  O     -2.459760   17.399407   19.489143     1  8225  8226
8226  8225  H     -2.105005   16.523801   19.335215     2  8224
8227  8226  H     -1.688170   17.959622   19.573044     2  8224
8228  8227  O     -6.886639   15.027621    6.646096     1  8228  8229
8229  8228  H     -6.831564   15.483280    5.806112     2  8227
8230  8229  H     -6.090080   14.498242    6.684633     2  8227
8231  8230  O    -10.762431    4.212688    5.239905     1  8231  8232
8232  8231  H    -11.084312    3.403474    4.842670     2  8230
8233  8232  H    -11.472936    4.496918    5.814907     2  8230
8234  8233  O    -16.305322   12.979888    6.522042     1  8234  8235
8235  8234  H    -16.531658   13.425493    7.338399     2  8233
8236  8235  H    -15.352328   13.050224    6.466476     2  8233
8237  8236  O    -13.631022   23.241776    5.305121     1  8237  8238
8238  8237  H    -12.825023   23.745866    5.193360     2  8236
8239  8238  H    -13.431677   22.384112    4.929748     2  8236
8240  8239  O     -4.961329   -3.828335   28.116504     1  8240  8241
8241  8240  H     -5.046130   -4.365462   28.904245     2  8239
8242  8241  H     -4.049756   -3.536384   28.122092     2  8239
8243  8242  O    -12.420558    6.171818   13.958183     1  8243  8244
8244  8243  H    -11.638949    6.379517   14.470218     2  8242
8245  8244  H    -12.323990    6.683092   13.154750     2  8242
8246  8245  O     -6.392390   29.095517   18.430986     1  8246  8247
8247  8246  H     -6.860754   28.603973   17.756262     2  8245
8248  8247  H     -6.977032   29.079794   19.188731     2  8245
8249  8248  O    -17.372438    8.733787    8.266285     1  8249  8250
8250  8249  H    -17.931197    8.572285    9.026507     2  8248
8251  8250  H    -17.518061    9.655463    8.052886     2  8248
8252  8251  O    -22.290742    4.341212   13.377418     1  8252  8253
8253  8252  H    -23.126354    4.711916   13.661255     2  8251
8254  8253  H    -22.420502    3.393956   13.423247     2  8251
8255  8254  O      1.358126    7.117396   14.021734     1  8255  8256
8256  8255  H      1.865071    7.863283   13.700967     2  8254
8257  8256  H      1.815804    6.350364   13.677607     2  8254
8258  8257  O     -1.844442   17.214509    6.759920     1  8258  8259
8259  8258  H     -2.244771   17.912967    6.242113     2  8257
8260  8259  H     -0.902563   17.362233    6.674625     2  8257
8261  8260  O    -11.567196   23.914464    7.106425     1  8261  8262
8262  8261  H    -12.354814   24.454150    7.174462     2  8260
8263  8262  H    -11.009263   24.381476    6.484458     2  8260
8264  8263  O     -9.135123   -5.832232   32.027308     1  8264  8265
8265  8264  H     -9.510596   -4.984153   31.790634     2  8263
8266  8265  H     -9.187223   -6.350310   31.224119     2  8263
8267  8266  O     10.522547  -32.365369   -9.214411     1  8267  8268
8268  8267  H      9.957330  -32.996300   -8.768666     2  8266
8269  8268  H     10.922687  -32.863351   -9.927245     2  8266
8270  8269  O     -2.995676    5.390032   11.886706     1  8270  8271
8271  8270  H     -3.257406    5.548620   12.793667     2  8269
8272  8271  H     -3.372965    4.536478   11.673796     2  8269
8273  8272  O    -10.213700    7.050053   15.364813     1  8273  8274
8274  8273  H    -10.017125    7.327244   16.259663     2  8272
8275  8274  H     -9.496653    7.406282   14.840241     2  8272
8276  8275  O    -12.943733   10.616316    7.869698     1  8276  8277
8277  8276  H    -12.151036   11.152618    7.885304     2  8275
8278  8277  H    -12.907648   10.159093    7.029534     2  8275
8279  8278  O     -0.737506   22.432740   13.822845     1  8279  8280
8280  8279  H     -1.047288   22.793828   14.653436     2  8278
8281  8280  H     -1.420332   21.815623   13.559888     2  8278
8282  8281  O    -12.089471    9.028715   16.893068     1  8282  8283
8283  8282  H    -11.595768    9.177229   17.699563     2  8281
8284  8283  H    -11.765421    8.190193   16.564277     2  8281
8285  8284  O    -11.323738   -2.598664    3.172367     1  8285  8286
8286  8285  H    -11.296819   -3.466866    3.574525     2  8284
8287  8286  H    -12.033816   -2.145512    3.626980     2  8284
8288  8287  O      0.936617  -32.382191   16.051636     1  8288  8289
8289  8288  H      1.254203  -32.964140   16.742076     2  8287
8290  8289  H      0.316859  -32.915794   15.554244     2  8287
8291  8290  O      1.146037   19.384826    0.407316     1  8291  8292
8292  8291  H      0.307735   18.926835    0.346275     2  8290
8293  8292  H      1.045162   20.147032   -0.162858     2  8290
8294  8293  O     30.365318  -10.413014  -12.753384     1  8294  8295
8295  8294  H     31.227757  -10.001375  -12.808023     2  8293
8296  8295  H     30.548518  -11.324857  -12.527085     2  8293
8297  8296  O     -3.185529    2.102631   14.099192     1  8297  8298
8298  8297  H     -2.880289    2.347660   14.972703     2  8296
8299  8298  H     -2.771971    2.737022   13.513745     2  8296
8300  8299  O     -6.820113   19.711770   25.978862     1  8300  8301
8301  8300  H     -6.919511   20.283673   25.217759     2  8299
8302  8301  H     -6.784245   20.309816   26.725378     2  8299
8303  8302  O     -9.740935   33.778998    2.660531     1  8303  8304
8304  8303  H     -9.559594   34.357822    3.401010     2  8302
8305  8304  H     -9.402399   34.250089    1.899152     2  8302
8306  8305  O     27.076489  -10.839229  -16.001572     1  8306  8307
8307  8306  H     27.322941  -11.637230  -16.469213     2  8305
8308  8307  H     26.667411  -10.287170  -16.667993     2  8305
8309  8308  O     -2.597007    3.095804   29.572663     1  8309  8310
8310  8309  H     -2.583064    4.044887   29.696270     2  8308
8311  8310  H     -2.679114    2.739748   30.457375     2  8308
8312  8311  O    -20.807268    8.593083    6.876019     1  8312  8313
8313  8312  H    -20.777568    9.172786    7.637133     2  8311
8314  8313  H    -20.533694    9.144862    6.143265     2  8311
8315  8314  O     21.909496  -24.475967   -7.762190     1  8315  8316
8316  8315  H     22.438736  -24.562001   -6.969262     2  8314
8317  8316  H     22.373062  -23.826447   -8.290830     2  8314
8318  8317  O     -7.105417   23.020770    5.198202     1  8318  8319
8319  8318  H     -6.362431   23.254345    4.641745     2  8317
8320  8319  H     -7.180073   22.070351    5.112398     2  8317
8321  8320  O     -4.234652   23.034276    4.805429     1  8321  8322
8322  8321  H     -3.758023   23.688757    5.316026     2  8320
8323  8322  H     -4.321325   22.285825    5.395802     2  8320
8324  8323  O     -5.320821    0.453577   24.404867     1  8324  8325
8325  8324  H     -5.576139   -0.066142   23.642675     2  8323
8326  8325  H     -4.932050    1.246414   24.035410     2  8323
8327  8326  O     -5.025986    1.957640   16.816266     1  8327  8328
8328  8327  H     -5.152362    1.514834   15.977109     2  8326
8329  8328  H     -4.507016    1.343675   17.335832     2  8326
8330  8329  O    -14.329099    1.325907   10.748922     1  8330  8331
8331  8330  H    -13.525725    1.396952   11.264455     2  8329
8332  8331  H    -14.510947    0.386711   10.716143     2  8329
8333  8332  O     -8.493515   23.618947   18.693633     1  8333  8334
8334  8333  H     -8.077829   22.758752   18.634470     2  8332
8335  8334  H     -8.728331   23.834600   17.791088     2  8332
8336  8335  O    -18.013544   -2.687057   11.315995     1  8336  8337
8337  8336  H    -18.730772   -2.868020   11.923505     2  8335
8338  8337  H    -18.036082   -1.737934   11.193980     2  8335
8339  8338  O    -12.455285   -0.105440   -0.319179     1  8339  8340
8340  8339  H    -12.327099   -1.037820   -0.144631     2  8338
8341  8340  H    -13.291357    0.103941    0.097204     2  8338
8342  8341  O     -8.990408   11.546601   -2.459194     1  8342  8343
8343  8342  H     -9.342627   12.208484   -3.054244     2  8341
8344  8343  H     -8.073340   11.793991   -2.340802     2  8341
8345  8344  O     16.677762   -5.346772  -30.069390     1  8345  8346
8346  8345  H     17.490652   -4.936730  -29.773910     2  8344
8347  8346  H     16.961913   -6.125953  -30.547266     2  8344
8348  8347  O    -17.598240   -1.310718    1.554067     1  8348  8349
8349  8348  H    -17.393239   -0.388245    1.706545     2  8347
8350  8349  H    -16.814796   -1.664207    1.132770     2  8347
8351  8350  O     22.943984  -25.376518   -0.132236     1  8351  8352
8352  8351  H     22.864176  -24.513095   -0.537652     2  8350
8353  8352  H     23.662314  -25.282424    0.493368     2  8350
8354  8353  O    -13.297980    5.976918    6.326566     1  8354  8355
8355  8354  H    -14.181237    5.788091    6.643478     2  8353
8356  8355  H    -12.979164    6.670809    6.903717     2  8353
8357  8356  O     -7.580102   35.861931    3.246640     1  8357  8358
8358  8357  H     -7.924087   35.864583    4.139892     2  8356
8359  8358  H     -6.750997   36.336411    3.307345     2  8356
8360  8359  O    -33.338820    2.342608    3.237770     1  8360  8361
8361  8360  H    -33.618113    1.803436    2.497823     2  8359
8362  8361  H    -32.493276    1.975910    3.496266     2  8359
8363  8362  O    -29.385716   10.461375   10.564564     1  8363  8364
8364  8363  H    -28.897840   11.217279   10.237736     2  8362
8365  8364  H    -30.235908   10.817672   10.822359     2  8362
8366  8365  O     -3.162579   14.291448   11.192056     1  8366  8367
8367  8366  H     -2.937827   13.526299   10.662655     2  8365
8368  8367  H     -3.003803   15.037991   10.614393     2  8365
8369  8368  O    -12.058745    8.426834    1.413714     1  8369  8370
8370  8369  H    -12.319558    7.934892    2.192303     2  8368
8371  8370  H    -12.016488    7.770574    0.718179     2  8368
8372  8371  O     -7.500920    2.789038   17.712145     1  8372  8373
8373  8372  H     -7.543117    3.658003   18.111333     2  8371
8374  8373  H     -6.570030    2.649859   17.538059     2  8371
8375  8374  O    -30.109857   15.107295    1.967152     1  8375  8376
8376  8375  H    -30.195409   14.400989    2.607500     2  8374
8377  8376  H    -30.945841   15.571642    2.008902     2  8374
8378  8377  O    -10.771183    9.900027   14.581853     1  8378  8379
8379  8378  H    -11.357869    9.663689   15.300305     2  8377
8380  8379  H    -10.597142    9.073121   14.132222     2  8377
8381  8380  O     -4.872391   34.554331    6.009281     1  8381  8382
8382  8381  H     -5.807504   34.438265    6.177576     2  8380
8383  8382  H     -4.440163   34.097381    6.730812     2  8380
8384  8383  O      2.513091    9.124755   12.177445     1  8384  8385
8385  8384  H      3.260997    8.550042   12.340452     2  8383
8386  8385  H      2.814552    9.722799   11.493562     2  8383
8387  8386  O     -5.902535    1.821734   13.822597     1  8387  8388
8388  8387  H     -4.975183    2.009532   13.967450     2  8386
8389  8388  H     -6.279444    2.661722   13.560699     2  8386
8390  8389  O     -4.872812   13.232623    6.842789     1  8390  8391
8391  8390  H     -3.950284   13.318404    6.602339     2  8389
8392  8391  H     -4.876426   12.595227    7.556892     2  8389
8393  8392  O    -15.635017    2.248524    6.516244     1  8393  8394
8394  8393  H    -15.681132    3.203175    6.568666     2  8392
8395  8394  H    -15.921358    2.042932    5.626316     2  8392
8396  8395  O    -31.596569   11.336614    5.061868     1  8396  8397
8397  8396  H    -30.988460   11.548421    5.770086     2  8395
8398  8397  H    -32.463259   11.506876    5.430772     2  8395
8399  8398  O    -19.873329   10.809889    5.235361     1  8399  8400
8400  8399  H    -19.003358   10.767925    5.632377     2  8398
8401  8400  H    -20.018445   11.742037    5.073272     2  8398
8402  8401  O    -10.700822    1.552249   32.707625     1  8402  8403
8403  8402  H    -11.648356    1.447004   32.621987     2  8401
8404  8403  H    -10.481938    2.258724   32.099994     2  8401
8405  8404  O    -16.920968    1.396580   29.618893     1  8405  8406
8406  8405  H    -16.506919    1.791092   30.386458     2  8404
8407  8406  H    -17.776679    1.103333   29.931935     2  8404
8408  8407  O      2.996042   17.634663   12.173599     1  8408  8409
8409  8408  H      2.170153   17.376480   12.582842     2  8407
8410  8409  H      2.790889   17.702589   11.241113     2  8407
8411  8410  O    -10.055669   12.984248   11.844675     1  8411  8412
8412  8411  H    -10.398476   12.785935   12.716103     2  8410
8413  8412  H    -10.508964   13.786420   11.585299     2  8410
8414  8413  O    -11.281060    2.898962   26.224733     1  8414  8415
8415  8414  H    -10.711414    2.994442   25.461439     2  8413
8416  8415  H    -12.147737    2.725674   25.857209     2  8413
8417  8416  O      4.179975  -14.276069  -22.979315     1  8417  8418
8418  8417  H      4.490955  -15.163255  -22.799249     2  8416
8419  8418  H      4.392643  -14.129673  -23.901037     2  8416
8420  8419  O    -14.880416   10.437348   10.037535     1  8420  8421
8421  8420  H    -15.606476    9.904166    9.713829     2  8419
8422  8421  H    -14.305195   10.544777    9.280032     2  8419
8423  8422  O    -32.274083   14.461756    4.711525     1  8423  8424
8424  8423  H    -31.500950   13.897459    4.703410     2  8422
8425  8424  H    -32.772433   14.197178    3.938299     2  8422
8426  8425  O     -2.940805   12.824382   19.511417     1  8426  8427
8427  8426  H     -3.053381   12.382472   18.669826     2  8425
8428  8427  H     -3.632720   12.464098   20.066106     2  8425
8429  8428  O    -13.493826   14.364220   18.186293     1  8429  8430
8430  8429  H    -12.641427   14.735793   18.413410     2  8428
8431  8430  H    -13.358451   13.958997   17.329731     2  8428
8432  8431  O     -5.520346   16.484276   14.863464     1  8432  8433
8433  8432  H     -4.845731   15.874063   15.161398     2  8431
8434  8433  H     -5.698031   16.223121   13.959884     2  8431
8435  8434  O     -1.152863   11.802653   16.059052     1  8435  8436
8436  8435  H     -1.488161   10.991646   15.676856     2  8434
8437  8436  H     -1.930787   12.343686   16.194508     2  8434
8438  8437  O     -4.239863   30.371874    9.493242     1  8438  8439
8439  8438  H     -4.518477   31.152955    9.971277     2  8437
8440  8439  H     -3.356659   30.579521    9.188176     2  8437
8441  8440  O     -3.581581   23.108816    8.649271     1  8441  8442
8442  8441  H     -4.174238   23.859293    8.691388     2  8440
8443  8442  H     -2.720065   23.492284    8.485039     2  8440
8444  8443  O    -10.455927    4.300881   32.197550     1  8444  8445
8445  8444  H    -10.026469    4.986943   32.708545     2  8443
8446  8445  H    -10.836092    4.761271   31.449388     2  8443
8447  8446  O    -10.892935   27.408474    9.539280     1  8447  8448
8448  8447  H    -11.194941   27.103603   10.394896     2  8446
8449  8448  H    -10.085457   26.919274    9.381504     2  8446
8450  8449  O     -3.238565   14.438923   -4.430162     1  8450  8451
8451  8450  H     -2.616937   14.960948   -4.937410     2  8449
8452  8451  H     -3.456966   13.703150   -5.002150     2  8449
8453  8452  O    -12.092058   12.272109   25.049016     1  8453  8454
8454  8453  H    -11.600669   11.909009   24.312179     2  8452
8455  8454  H    -12.300563   13.166978   24.780749     2  8452
8456  8455  O     -2.060243    2.844503   19.283515     1  8456  8457
8457  8456  H     -1.593395    2.109701   19.681448     2  8455
8458  8457  H     -2.931732    2.817332   19.678483     2  8455
8459  8458  O     -6.423822   19.114317    5.928075     1  8459  8460
8460  8459  H     -6.994965   19.613126    5.343938     2  8458
8461  8460  H     -7.009243   18.496711    6.366341     2  8458
8462  8461  O     30.643794   -4.574371  -14.173161     1  8462  8463
8463  8462  H     30.827819   -3.706706  -14.533055     2  8461
8464  8463  H     31.505267   -4.934259  -13.962027     2  8461
8465  8464  O    -10.829919   -3.756244    9.739611     1  8465  8466
8466  8465  H    -10.467855   -3.006607   10.212036     2  8464
8467  8466  H    -10.078077   -4.142996    9.290847     2  8464
8468  8467  O      1.903650   21.260604   10.517610     1  8468  8469
8469  8468  H      1.736404   20.321959   10.602500     2  8467
8470  8469  H      2.833353   21.319792   10.297655     2  8467
8471  8470  O     -4.635058   -4.788121   14.336795     1  8471  8472
8472  8471  H     -4.086620   -4.502107   13.606287     2  8470
8473  8472  H     -4.396531   -5.705327   14.471221     2  8470
8474  8473  O     -2.741350    8.477488   19.182611     1  8474  8475
8475  8474  H     -2.226845    7.684016   19.330655     2  8473
8476  8475  H     -2.104948    9.190234   19.239326     2  8473
8477  8476  O     -4.189842   25.390404   20.416309     1  8477  8478
8478  8477  H     -4.707935   24.652279   20.095401     2  8476
8479  8478  H     -4.809281   26.119056   20.456217     2  8476
8480  8479  O      0.848358   15.056234   21.678994     1  8480  8481
8481  8480  H      1.093114   15.406116   20.822309     2  8479
8482  8481  H     -0.106053   15.125301   21.702670     2  8479
8483  8482  O    -12.002302    1.661632   13.298762     1  8483  8484
8484  8483  H    -12.072597    1.037204   14.020829     2  8482
8485  8484  H    -11.448721    2.363353   13.641350     2  8482
8486  8485  O     34.991172  -18.375138   -0.342404     1  8486  8487
8487  8486  H     35.690702  -18.352827   -0.995391     2  8485
8488  8487  H     34.373337  -19.026345   -0.674734     2  8485
8489  8488  O    -17.697552    2.318706    8.720620     1  8489  8490
8490  8489  H    -17.253912    2.279872    9.567915     2  8488
8491  8490  H    -16.987694    2.344467    8.079005     2  8488
8492  8491  O    -13.575899   11.462172   20.145452     1  8492  8493
8493  8492  H    -14.327511   10.882822   20.020297     2  8491
8494  8493  H    -13.892120   12.139853   20.742934     2  8491
8495  8494  O      0.261984    8.869933    5.187782     1  8495  8496
8496  8495  H      0.242923    7.955293    5.469389     2  8494
8497  8496  H      0.821153    8.870238    4.410890     2  8494
8498  8497  O     -9.034667    5.981866   33.876439     1  8498  8499
8499  8498  H     -9.733787    5.845398   34.515844     2  8497
8500  8499  H     -8.232393    5.999919   34.398226     2  8497
8501  8500  O      2.085838  -29.511634  -17.338394     1  8501  8502
8502  8501  H      1.634164  -30.354579  -17.297592     2  8500
8503  8502  H      2.255850  -29.285947  -16.423849     2  8500
8504  8503  O     -1.577566    7.509025   13.586620     1  8504  8505
8505  8504  H     -1.513118    7.241008   12.669972     2  8503
8506  8505  H     -0.682635    7.442402   13.919626     2  8503
8507  8506  O    -10.889426    3.542983   -1.429643     1  8507  8508
8508  8507  H    -10.773453    4.315009   -1.983500     2  8506
8509  8508  H    -11.808271    3.300767   -1.544911     2  8506
8510  8509  O    -12.098708  -31.909510    4.711167     1  8510  8511
8511  8510  H    -12.880976  -31.576258    5.150747     2  8509
8512  8511  H    -11.764272  -32.587790    5.297957     2  8509
8513  8512  O     -0.147584   10.728894   18.559227     1  8513  8514
8514  8513  H     -0.406306   11.231406   17.786714     2  8512
8515  8514  H      0.616192   10.227140   18.274408     2  8512
8516  8515  O    -12.304047    4.486372    1.612964     1  8516  8517
8517  8516  H    -12.352075    5.227226    2.217167     2  8515
8518  8517  H    -11.748527    4.795806    0.897507     2  8515
8519  8518  O     -8.166297    8.027446   14.138933     1  8519  8520
8520  8519  H     -7.540666    7.747741   13.470665     2  8518
8521  8520  H     -7.940946    8.941690   14.310996     2  8518
8522  8521  O    -12.039374    6.456533  -32.874251     1  8522  8523
8523  8522  H    -11.449138    6.322953  -32.132625     2  8521
8524  8523  H    -12.287465    5.572799  -33.145725     2  8521
8525  8524  O    -10.217640   -3.276980   15.730117     1  8525  8526
8526  8525  H    -10.772532   -3.900559   15.261635     2  8524
8527  8526  H    -10.572886   -3.260127   16.618795     2  8524
8528  8527  O      0.947261   18.127225   31.070888     1  8528  8529
8529  8528  H      1.657622   18.389264   30.485265     2  8527
8530  8529  H      0.783125   17.209610   30.853461     2  8527
8531  8530  O    -22.334002    6.199511    7.215600     1  8531  8532
8532  8531  H    -21.877004    6.890507    6.736112     2  8530
8533  8532  H    -21.795868    5.419101    7.082921     2  8530
8534  8533  O     -4.561813    9.627750   15.780746     1  8534  8535
8535  8534  H     -4.421203    8.928464   16.419071     2  8533
8536  8535  H     -3.797891    9.584835   15.205582     2  8533
8537  8536  O     -8.782863  -29.737273    9.778676     1  8537  8538
8538  8537  H     -8.462779  -30.127097    8.965156     2  8536
8539  8538  H     -8.420138  -28.851462    9.779301     2  8536
8540  8539  O    -31.869919    8.816889    3.180667     1  8540  8541
8541  8540  H    -31.870402    9.659215    3.635329     2  8539
8542  8541  H    -32.359274    8.231763    3.758933     2  8539
8543  8542  O    -18.671045    8.540349   10.975302     1  8543  8544
8544  8543  H    -19.311149    7.905523   10.653597     2  8542
8545  8544  H    -18.278000    8.118654   11.739449     2  8542
8546  8545  O     -7.573393   18.016201   18.391722     1  8546  8547
8547  8546  H     -7.093010   18.542186   17.752344     2  8545
8548  8547  H     -7.395817   17.110181   18.139083     2  8545
8549  8548  O     -9.482713   10.935205    0.117431     1  8549  8550
8550  8549  H     -9.268231   10.018349    0.289490     2  8548
8551  8550  H     -9.240168   11.070591   -0.798579     2  8548
8552  8551  O     20.943513  -26.181539   -4.765472     1  8552  8553
8553  8552  H     21.002285  -27.136924   -4.769620     2  8551
8554  8553  H     21.831720  -25.885590   -4.964806     2  8551
8555  8554  O    -15.716731   -0.635910   18.847173     1  8555  8556
8556  8555  H    -15.752916    0.039993   18.170358     2  8554
8557  8556  H    -15.039161   -1.241187   18.545895     2  8554
8558  8557  O     -2.612889   10.392142   11.781582     1  8558  8559
8559  8558  H     -3.251410   10.976574   11.372972     2  8557
8560  8559  H     -1.785597   10.598947   11.346780     2  8557
8561  8560  O     -5.591506   21.327762   14.457134     1  8561  8562
8562  8561  H     -5.996431   22.190470   14.367679     2  8560
8563  8562  H     -6.028392   20.788108   13.798244     2  8560
8564  8563  O    -12.859574   21.516402    3.285897     1  8564  8565
8565  8564  H    -12.595553   20.674810    3.657712     2  8563
8566  8565  H    -13.762785   21.379686    2.999979     2  8563
8567  8566  O    -10.341634   15.094272   16.092553     1  8567  8568
8568  8567  H    -11.048481   15.352338   15.500944     2  8566
8569  8568  H     -9.553330   15.474308   15.704763     2  8566
8570  8569  O     -3.568403   11.163572   28.615882     1  8570  8571
8571  8570  H     -4.181423   11.432623   27.931741     2  8569
8572  8571  H     -4.046883   11.299217   29.433738     2  8569
8573  8572  O     -5.602374   -3.770609   10.367102     1  8573  8574
8574  8573  H     -4.785426   -3.453942   10.752524     2  8572
8575  8574  H     -6.091175   -2.975682   10.154040     2  8572
8576  8575  O     -1.764486   10.076719    7.761835     1  8576  8577
8577  8576  H     -2.485812    9.566896    7.393051     2  8575
8578  8577  H     -1.207931   10.283048    7.010899     2  8575
8579  8578  O    -12.344049    4.355256   23.961004     1  8579  8580
8580  8579  H    -11.966945    3.481146   23.861231     2  8578
8581  8580  H    -11.691990    4.942931   23.579312     2  8578
8582  8581  O      2.975670   -0.693840   23.797876     1  8582  8583
8583  8582  H      2.280301   -0.189611   23.375448     2  8581
8584  8583  H      3.099628   -0.267883   24.646067     2  8581
8585  8584  O     15.231616  -11.200739  -26.872300     1  8585  8586
8586  8585  H     15.923131  -11.805141  -26.602602     2  8584
8587  8586  H     14.747053  -11.016055  -26.067736     2  8584
8588  8587  O    -12.273180   19.760090    8.900138     1  8588  8589
8589  8588  H    -12.595554   19.364354    8.090385     2  8587
8590  8589  H    -12.588923   19.180031    9.593008     2  8587
8591  8590  O     -4.965432   15.836277   19.635730     1  8591  8592
8592  8591  H     -4.191323   16.392370   19.723751     2  8590
8593  8592  H     -5.021224   15.368926   20.469217     2  8590
8594  8593  O     -8.723106    2.491139   30.631986     1  8594  8595
8595  8594  H     -9.124226    3.298575   30.953515     2  8593
8596  8595  H     -8.906707    2.489518   29.692561     2  8593
8597  8596  O     -7.529279   13.114261   26.030608     1  8597  8598
8598  8597  H     -8.430802   13.430041   26.092011     2  8596
8599  8598  H     -6.993584   13.905690   26.084476     2  8596
8600  8599  O    -18.120685    6.935311    5.512963     1  8600  8601
8601  8600  H    -17.890425    7.386158    4.700590     2  8599
8602  8601  H    -18.719069    7.534790    5.958824     2  8599
8603  8602  O    -12.497544   34.559960    3.599781     1  8603  8604
8604  8603  H    -11.858083   34.108254    3.049070     2  8602
8605  8604  H    -12.031936   35.330093    3.925871     2  8602
8606  8605  O    -15.782179   14.893458    9.014663     1  8606  8607
8607  8606  H    -16.177676   14.716856    9.868259     2  8605
8608  8607  H    -14.956267   15.332052    9.218959     2  8605
8609  8608  O     -8.057976    7.104929   21.866210     1  8609  8610
8610  8609  H     -7.848489    7.860954   21.317782     2  8608
8611  8610  H     -7.290732    6.996088   22.428101     2  8608
8612  8611  O     13.594789   -9.479341  -19.326431     1  8612  8613
8613  8612  H     12.663034   -9.396823  -19.529546     2  8611
8614  8613  H     13.646678  -10.234216  -18.740170     2  8611
8615  8614  O     -2.257516    9.879206   14.421136     1  8615  8616
8616  8615  H     -1.809118    9.104960   14.080967     2  8614
8617  8616  H     -2.540803   10.354900   13.640306     2  8614
8618  8617  O     -8.291944    4.219548   -0.683489     1  8618  8619
8619  8618  H     -9.014151    3.709979   -1.050896     2  8617
8620  8619  H     -8.185063    4.954376   -1.287507     2  8617
8621  8620  O      0.820830   10.577689   30.728095     1  8621  8622
8622  8621  H      0.126548   11.138676   30.382411     2  8620
8623  8622  H      0.472422    9.689490   30.650977     2  8620
8624  8623  O     -0.681978   17.290660   23.645625     1  8624  8625
8625  8624  H      0.137355   17.637598   23.292696     2  8623
8626  8625  H     -1.060004   18.020434   24.136297     2  8623
8627  8626  O     -3.445936    2.033008   32.098000     1  8627  8628
8628  8627  H     -4.304208    1.713343   31.819763     2  8626
8629  8628  H     -3.135140    1.375482   32.720332     2  8626
8630  8629  O     -0.675049   19.691943   16.925440     1  8630  8631
8631  8630  H     -0.242335   19.833453   17.767440     2  8629
8632  8631  H      0.013968   19.829538   16.275399     2  8629
8633  8632  O      2.937785   16.186563    6.378174     1  8633  8634
8634  8633  H      3.009397   15.597684    7.129388     2  8632
8635  8634  H      3.034186   15.615840    5.615800     2  8632
8636  8635  O     -4.637333   25.508926    9.485141     1  8636  8637
8637  8636  H     -4.108612   25.032739   10.125400     2  8635
8638  8637  H     -4.328601   26.413066    9.543853     2  8635
8639  8638  O      6.528709   -1.620254    7.772223     1  8639  8640
8640  8639  H      6.611169   -2.528172    8.063969     2  8638
8641  8640  H      5.760919   -1.287604    8.237062     2  8638
8642  8641  O     -3.258675   15.865211   34.960772     1  8642  8643
8643  8642  H     -3.148185   16.163962   34.058125     2  8641
8644  8643  H     -2.767465   15.044791   35.003854     2  8641
8645  8644  O     -6.088917    9.648773   31.246286     1  8645  8646
8646  8645  H     -6.775963    9.316891   31.824260     2  8644
8647  8646  H     -5.650374   10.327227   31.759718     2  8644
8648  8647  O    -34.006370    8.390427    1.415723     1  8648  8649
8649  8648  H    -34.502523    8.421668    2.233701     2  8647
8650  8649  H    -34.454285    7.728908    0.888468     2  8647
8651  8650  O    -10.017306   -0.917571   20.837189     1  8651  8652
8652  8651  H     -9.611614   -0.928432   21.704096     2  8650
8653  8652  H    -10.514176   -1.734596   20.794493     2  8650
8654  8653  O     -7.193663   -1.617496    9.297288     1  8654  8655
8655  8654  H     -7.536520   -1.251883    8.481808     2  8653
8656  8655  H     -7.267752   -0.903341    9.930317     2  8653
8657  8656  O     -9.280170   11.378846   24.353267     1  8657  8658
8658  8657  H     -8.738120   12.058394   24.754052     2  8656
8659  8658  H     -9.165073   10.615342   24.918993     2  8656
8660  8659  O     -7.091759   17.281569    8.144116     1  8660  8661
8661  8660  H     -7.660523   17.062911    8.882307     2  8659
8662  8661  H     -6.916630   16.441942    7.719158     2  8659
8663  8662  O     -9.151784   26.680090    2.666374     1  8663  8664
8664  8663  H     -8.202401   26.604997    2.762621     2  8662
8665  8664  H     -9.476783   25.788226    2.789602     2  8662
8666  8665  O      2.923001   16.898017   33.944385     1  8666  8667
8667  8666  H      2.004288   16.629551   33.955574     2  8665
8668  8667  H      3.103038   17.175017   34.842767     2  8665
8669  8668  O      0.502134   16.511535   12.210341     1  8669  8670
8670  8669  H     -0.215858   16.435914   12.838832     2  8668
8671  8670  H      0.435996   15.721337   11.674202     2  8668
8672  8671  O    -14.707029   18.478877   17.383095     1  8672  8673
8673  8672  H    -13.775346   18.600676   17.200438     2  8671
8674  8673  H    -14.964510   17.738532   16.833710     2  8671
8675  8674  O     -8.114175   22.247526    0.599800     1  8675  8676
8676  8675  H     -7.290192   22.192082    1.083751     2  8674
8677  8676  H     -7.851062   22.270191   -0.320249     2  8674
8678  8677  O     -9.490432   17.565412   12.407380     1  8678  8679
8679  8678  H     -9.430581   17.058162   11.597845     2  8677
8680  8679  H     -9.751375   18.441349   12.122994     2  8677
8681  8680  O     -1.635756   12.519608   23.276004     1  8681  8682
8682  8681  H     -2.037272   13.180739   22.712158     2  8680
8683  8682  H     -0.880898   12.205876   22.778015     2  8680
8684  8683  O    -10.930953   14.747216   18.762369     1  8684  8685
8685  8684  H    -10.777730   13.846265   19.047047     2  8683
8686  8685  H    -10.523427   14.798298   17.897761     2  8683
8687  8686  O     23.318811  -11.691159  -17.983570     1  8687  8688
8688  8687  H     22.410096  -11.965092  -17.859351     2  8686
8689  8688  H     23.818101  -12.230969  -17.370753     2  8686
8690  8689  O     -0.277440   21.383302   19.150290     1  8690  8691
8691  8690  H      0.559206   21.077077   19.500263     2  8689
8692  8691  H     -0.865647   21.389399   19.905411     2  8689
8693  8692  O    -13.508035   -1.808989    4.819686     1  8693  8694
8694  8693  H    -13.084496   -1.628829    5.658965     2  8692
8695  8694  H    -14.386844   -2.107682    5.053585     2  8692
8696  8695  O     -3.863879    2.891834   10.512339     1  8696  8697
8697  8696  H     -3.445995    2.038532   10.628446     2  8695
8698  8697  H     -4.772735    2.686168   10.293449     2  8695
8699  8698  O      2.795677   14.817364    4.121072     1  8699  8700
8700  8699  H      1.920853   14.937439    3.751616     2  8698
8701  8700  H      3.297407   14.401839    3.419760     2  8698
8702  8701  O     -5.296858   11.719607   26.408776     1  8702  8703
8703  8702  H     -6.195336   12.047362   26.448096     2  8701
8704  8703  H     -5.078941   11.727921   25.476749     2  8701
8705  8704  O     -5.727311  -33.996783   14.094345     1  8705  8706
8706  8705  H     -5.806287  -33.151137   13.652897     2  8704
8707  8706  H     -6.025187  -34.634756   13.445892     2  8704
8708  8707  O      3.854532   10.601795   31.332342     1  8708  8709
8709  8708  H      3.080348   10.612864   30.769537     2  8707
8710  8709  H      4.409136   11.303511   30.991401     2  8707
8711  8710  O    -18.423957   -7.950722   16.596924     1  8711  8712
8712  8711  H    -18.506281   -8.887260   16.776792     2  8710
8713  8712  H    -17.589869   -7.867523   16.134748     2  8710
8714  8713  O     -6.628255   23.928213   -2.718388     1  8714  8715
8715  8714  H     -6.035398   24.512109   -3.191481     2  8713
8716  8715  H     -7.019566   24.480497   -2.041564     2  8713
8717  8716  O     -7.090240   10.520365   14.654667     1  8717  8718
8718  8717  H     -7.645653   11.186785   15.059181     2  8716
8719  8718  H     -6.296075   10.513220   15.188974     2  8716
8720  8719  O     -8.350968    9.351206   26.223485     1  8720  8721
8721  8720  H     -8.615382    8.435611   26.134029     2  8719
8722  8721  H     -7.585120    9.324887   26.797085     2  8719
8723  8722  O    -21.244958    2.913459   10.860131     1  8723  8724
8724  8723  H    -21.562069    3.782638   11.105488     2  8722
8725  8724  H    -20.857580    3.035186    9.993325     2  8722
8726  8725  O      0.180135   18.433215    9.839782     1  8726  8727
8727  8726  H     -0.692500   18.317717    9.463750     2  8725
8728  8727  H      0.175709   17.889898   10.627829     2  8725
8729  8728  O     -3.859055   12.160935   16.869636     1  8729  8730
8730  8729  H     -4.274057   11.312430   16.714578     2  8728
8731  8730  H     -4.536402   12.802225   16.654743     2  8728
8732  8731  O     -9.556550   26.212919   15.000097     1  8732  8733
8733  8732  H     -9.307050   26.540007   14.135808     2  8731
8734  8733  H    -10.385140   25.756505   14.853960     2  8731
8735  8734  O     29.787440    2.061341    7.048151     1  8735  8736
8736  8735  H     30.724905    2.029624    7.238900     2  8734
8737  8736  H     29.376840    2.246853    7.892678     2  8734
8738  8737  O    -22.038837   10.239293   11.807959     1  8738  8739
8739  8738  H    -21.924221   10.372481   12.748892     2  8737
8740  8739  H    -22.617294    9.479525   11.741830     2  8737
8741  8740  O     19.110559   -0.846535  -31.088030     1  8741  8742
8742  8741  H     20.017064   -1.068460  -31.300702     2  8740
8743  8742  H     19.076475   -0.867146  -30.131659     2  8740
8744  8743  O     -7.285738   -2.875215   31.765553     1  8744  8745
8745  8744  H     -7.497350   -1.942030   31.790443     2  8743
8746  8745  H     -7.403773   -3.172210   32.667824     2  8743
8747  8746  O     -6.285239    1.396802   31.059979     1  8747  8748
8748  8747  H     -5.995822    1.177570   30.174312     2  8746
8749  8748  H     -7.183034    1.709504   30.948565     2  8746
8750  8749  O     -4.876270   23.280689   24.249018     1  8750  8751
8751  8750  H     -5.292165   22.418562   24.249994     2  8749
8752  8751  H     -4.218014   23.228810   23.556024     2  8749
8753  8752  O    -14.692671    3.150562   28.704498     1  8753  8754
8754  8753  H    -14.678819    3.237164   27.751324     2  8752
8755  8754  H    -15.408901    2.540173   28.879633     2  8752
8756  8755  O     -7.702191    6.573366   -1.992584     1  8756  8757
8757  8756  H     -8.271292    7.057946   -2.590529     2  8755
8758  8757  H     -6.850727    7.003772   -2.069994     2  8755
8759  8758  O    -13.382002    2.955654    8.432765     1  8759  8760
8760  8759  H    -13.837325    2.546922    9.168870     2  8758
8761  8760  H    -13.842117    2.633996    7.657483     2  8758
8762  8761  O     -2.094948   30.816573   16.001763     1  8762  8763
8763  8762  H     -1.896219   30.356623   16.817351     2  8761
8764  8763  H     -1.684937   30.284277   15.320013     2  8761
8765  8764  O    -12.689548   15.613284   14.612162     1  8765  8766
8766  8765  H    -13.397438   16.017343   15.114017     2  8764
8767  8766  H    -12.925937   14.686837   14.566900     2  8764
8768  8767  O     -6.586639   15.575750   17.433008     1  8768  8769
8769  8768  H     -5.932536   15.601792   18.131365     2  8767
8770  8769  H     -6.218931   16.123217   16.739249     2  8767
8771  8770  O    -11.188503    1.774701   22.781187     1  8771  8772
8772  8771  H    -10.277576    1.555001   22.585800     2  8770
8773  8772  H    -11.692823    1.039965   22.431822     2  8770
8774  8773  O     -6.566885   -0.045967   20.788822     1  8774  8775
8775  8774  H     -6.999738   -0.575820   20.119400     2  8773
8776  8775  H     -6.308965   -0.674738   21.462882     2  8773
8777  8776  O     -9.320010   15.599132   26.736669     1  8777  8778
8778  8777  H    -10.143856   16.058116   26.900506     2  8776
8779  8778  H     -8.642485   16.252146   26.912068     2  8776
8780  8779  O      8.867858   11.818407    3.387550     1  8780  8781
8781  8780  H      8.023037   12.202419    3.622165     2  8779
8782  8781  H      9.487946   12.207676    4.004146     2  8779
8783  8782  O     -6.837479   12.531430   19.812144     1  8783  8784
8784  8783  H     -6.789560   13.329870   19.286381     2  8782
8785  8784  H     -7.257598   12.805716   20.627313     2  8782
8786  8785  O    -32.878864    6.540214    4.614225     1  8786  8787
8787  8786  H    -32.006716    6.171015    4.753086     2  8785
8788  8787  H    -33.466320    5.784982    4.641600     2  8785
8789  8788  O      0.670188   11.125233    6.397318     1  8789  8790
8790  8789  H      0.630584   11.199012    5.443788     2  8788
8791  8790  H      0.698793   10.183117    6.564146     2  8788
8792  8791  O     -4.066401    0.757965    6.896110     1  8792  8793
8793  8792  H     -3.954686    1.304285    6.118108     2  8791
8794  8793  H     -3.479214    1.143446    7.546377     2  8791
8795  8794  O     -5.803937   22.653576   20.453545     1  8795  8796
8796  8795  H     -6.027018   22.525291   19.531586     2  8794
8797  8796  H     -6.645806   22.636776   20.908745     2  8794
8798  8797  O      4.260814   33.459036  -12.212869     1  8798  8799
8799  8798  H      3.732986   32.878668  -12.761324     2  8797
8800  8799  H      5.105913   33.508449  -12.659632     2  8797
8801  8800  O     -7.396822    0.010014   11.714339     1  8801  8802
8802  8801  H     -6.763065   -0.327928   12.347094     2  8800
8803  8802  H     -6.974970    0.784601   11.342470     2  8800
8804  8803  O    -12.708143   -0.545427   22.394985     1  8804  8805
8805  8804  H    -12.482901   -1.176682   23.078371     2  8803
8806  8805  H    -13.497094   -0.903523   21.988099     2  8803
8807  8806  O    -10.786575    5.735098   36.109249     1  8807  8808
8808  8807  H    -11.430562    6.301935   36.533758     2  8806
8809  8808  H    -11.221079    4.884656   36.044540     2  8806
8810  8809  O      5.836784  -31.393912  -15.974935     1  8810  8811
8811  8810  H      6.701120  -31.396649  -15.563661     2  8809
8812  8811  H      5.303164  -30.836756  -15.408314     2  8809
8813  8812  O     -5.130412   18.868449    9.301421     1  8813  8814
8814  8813  H     -5.859384   18.714379    9.902331     2  8812
8815  8814  H     -5.520692   18.805875    8.429642     2  8812
8816  8815  O    -11.661576    7.925205    8.977781     1  8816  8817
8817  8816  H    -10.732835    8.011676    8.762848     2  8815
8818  8817  H    -12.034759    8.784081    8.779543     2  8815
8819  8818  O     -3.090463   13.489828   -1.746355     1  8819  8820
8820  8819  H     -3.177484   13.450811   -2.698792     2  8818
8821  8820  H     -2.518603   12.754155   -1.527280     2  8818
8822  8821  O     -9.097229   32.421817    8.276604     1  8822  8823
8823  8822  H     -9.477742   31.569614    8.489191     2  8821
8824  8823  H     -8.947833   32.836609    9.126228     2  8821
8825  8824  O    -14.329198    2.670895   15.598896     1  8825  8826
8826  8825  H    -13.418693    2.816278   15.855948     2  8824
8827  8826  H    -14.771152    3.494610   15.804813     2  8824
8828  8827  O    -16.255421   23.883209    4.828123     1  8828  8829
8829  8828  H    -15.313636   23.727464    4.757295     2  8827
8830  8829  H    -16.483404   24.346174    4.021947     2  8827
8831  8830  O     -3.073902   13.599144   13.861763     1  8831  8832
8832  8831  H     -3.788103   12.972972   13.743200     2  8830
8833  8832  H     -2.927123   13.963838   12.989018     2  8830
8834  8833  O     -6.575066   32.288081    3.830450     1  8834  8835
8835  8834  H     -5.681929   32.163764    3.509385     2  8833
8836  8835  H     -6.925239   33.000719    3.295887     2  8833
8837  8836  O     -0.960091   13.149238    0.741495     1  8837  8838
8838  8837  H     -0.021438   13.262224    0.891145     2  8836
8839  8838  H     -1.014424   12.519089    0.023030     2  8836
8840  8839  O    -13.437312   13.274844    6.127666     1  8840  8841
8841  8840  H    -13.043834   12.782589    5.407185     2  8839
8842  8841  H    -12.700323   13.498988    6.695854     2  8839
8843  8842  O     -6.120077   26.160342    3.725776     1  8843  8844
8844  8843  H     -5.877919   27.083249    3.649405     2  8842
8845  8844  H     -5.757724   25.751327    2.939875     2  8842
8846  8845  O     -4.500343    1.738344   20.448031     1  8846  8847
8847  8846  H     -4.732382    2.607081   20.776187     2  8845
8848  8847  H     -5.304714    1.226636   20.533902     2  8845
8849  8848  O     15.695263   -8.643906  -28.308210     1  8849  8850
8850  8849  H     15.770279   -9.590847  -28.426138     2  8848
8851  8850  H     16.446621   -8.409645  -27.763404     2  8848
8852  8851  O     -7.772248   23.109686   13.834819     1  8852  8853
8853  8852  H     -8.584229   22.841982   13.404408     2  8851
8854  8853  H     -7.311738   23.629776   13.176285     2  8851
8855  8854  O      1.013360    6.302798    6.180169     1  8855  8856
8856  8855  H      1.778980    6.429511    6.740527     2  8854
8857  8856  H      0.953582    5.354266    6.066390     2  8854
8858  8857  O     -0.436122    5.719711   34.764908     1  8858  8859
8859  8858  H     -0.040456    6.114945   35.541742     2  8857
8860  8859  H     -0.280020    6.355231   34.066354     2  8857
8861  8860  O     19.127144   -1.721388  -28.217596     1  8861  8862
8862  8861  H     18.987778   -0.835842  -27.882011     2  8860
8863  8862  H     18.599131   -2.280044  -27.647213     2  8860
8864  8863  O    -16.653729    2.520264   11.106919     1  8864  8865
8865  8864  H    -16.541852    3.344291   11.580938     2  8863
8866  8865  H    -15.780025    2.129439   11.095501     2  8863
8867  8866  O      1.555808  -33.704353   -8.205317     1  8867  8868
8868  8867  H      1.333029  -32.775553   -8.142617     2  8866
8869  8868  H      0.998493  -34.129363   -7.553398     2  8866
8870  8869  O     -4.010781   28.599748    0.337618     1  8870  8871
8871  8870  H     -3.523241   28.007940    0.910591     2  8869
8872  8871  H     -3.871346   28.250539   -0.542634     2  8869
8873  8872  O     29.434626   -0.928375  -23.881444     1  8873  8874
8874  8873  H     28.765752   -0.487553  -23.357503     2  8872
8875  8874  H     29.807791   -1.583804  -23.292043     2  8872
8876  8875  O     27.950140  -25.516319    0.997286     1  8876  8877
8877  8876  H     28.743296  -25.998346    1.231348     2  8875
8878  8877  H     27.999254  -25.420798    0.046132     2  8875
8879  8878  O     30.719561   -0.223681   -8.927913     1  8879  8880
8880  8879  H     30.069504   -0.153979   -9.627055     2  8878
8881  8880  H     31.460139   -0.675055   -9.332929     2  8878
8882  8881  O    -27.400977   12.574802    9.516110     1  8882  8883
8883  8882  H    -26.624583   13.108601    9.347281     2  8881
8884  8883  H    -28.073008   13.204464    9.777131     2  8881
8885  8884  O    -10.565853   21.956474    8.448511     1  8885  8886
8886  8885  H    -11.311597   21.375583    8.599050     2  8884
8887  8886  H    -10.927477   22.685622    7.944723     2  8884
8888  8887  O    -29.935913    3.836800    7.835815     1  8888  8889
8889  8888  H    -29.681510    4.099515    8.720401     2  8887
8890  8889  H    -30.884552    3.718536    7.884076     2  8887
8891  8890  O     -2.882939   18.209187   10.896823     1  8891  8892
8892  8891  H     -3.411664   18.710966   10.276420     2  8890
8893  8892  H     -2.699901   17.385483   10.444894     2  8890
8894  8893  O     -5.230287   -0.641556    3.972762     1  8894  8895
8895  8894  H     -5.603653   -1.441202    3.602092     2  8893
8896  8895  H     -4.656431   -0.947752    4.675019     2  8893
8897  8896  O    -29.122725   16.649375   -0.146423     1  8897  8898
8898  8897  H    -28.596054   17.209169    0.424085     2  8896
8899  8898  H    -29.512915   16.004647    0.443754     2  8896
8900  8899  O    -21.370429   17.879685    7.879324     1  8900  8901
8901  8900  H    -21.126684   17.263041    7.188984     2  8899
8902  8901  H    -20.579533   17.969685    8.410940     2  8899
8903  8902  O     -7.504755   28.838728    8.944922     1  8903  8904
8904  8903  H     -8.201584   29.376902    8.569384     2  8902
8905  8904  H     -6.784192   28.907843    8.318628     2  8902
8906  8905  O    -12.916160   28.658694    1.277843     1  8906  8907
8907  8906  H    -12.529863   28.815423    2.139493     2  8905
8908  8907  H    -13.399984   27.838782    1.377289     2  8905
8909  8908  O    -24.929050    1.575971   11.247215     1  8909  8910
8910  8909  H    -24.615505    1.877426   10.394545     2  8908
8911  8910  H    -24.470433    0.748486   11.392715     2  8908
8912  8911  O    -20.337106   15.496784    9.866686     1  8912  8913
8913  8912  H    -20.543853   15.220300   10.759459     2  8911
8914  8913  H    -19.960074   16.370821    9.967374     2  8911
8915  8914  O     29.558685   -6.581374  -12.779916     1  8915  8916
8916  8915  H     28.930443   -7.201475  -13.150076     2  8914
8917  8916  H     29.674102   -5.920371  -13.462547     2  8914
8918  8917  O    -18.457491   27.424889   -0.695957     1  8918  8919
8919  8918  H    -18.341278   28.341599   -0.446220     2  8917
8920  8919  H    -19.357038   27.219055   -0.441636     2  8917
8921  8920  O     -9.386577    4.189408   12.947977     1  8921  8922
8922  8921  H     -8.483606    4.499950   13.014589     2  8920
8923  8922  H     -9.733904    4.269050   13.836376     2  8920
8924  8923  O      3.048702   16.402384   15.809224     1  8924  8925
8925  8924  H      3.202298   15.464006   15.919167     2  8923
8926  8925  H      2.146797   16.462664   15.494319     2  8923
8927  8926  O    -26.213171   -5.241641    5.116728     1  8927  8928
8928  8927  H    -27.160594   -5.374763    5.146715     2  8926
8929  8928  H    -25.847807   -6.125440    5.076232     2  8926
8930  8929  O     -3.838453   22.004623   10.937361     1  8930  8931
8931  8930  H     -3.322821   22.357634   10.212283     2  8929
8932  8931  H     -4.696755   21.822115   10.554948     2  8929
8933  8932  O     -1.891594   -3.976998   35.874744     1  8933  8934
8934  8933  H     -1.852715   -3.128003   36.315116     2  8932
8935  8934  H     -2.502355   -4.492715   36.401279     2  8932
8936  8935  O     -0.533974   22.644030   10.720236     1  8936  8937
8937  8936  H     -0.759323   22.217237   11.546854     2  8935
8938  8937  H      0.400356   22.469581   10.606981     2  8935
8939  8938  O      3.416964   22.871546   25.423231     1  8939  8940
8940  8939  H      3.938834   23.153150   24.671844     2  8938
8941  8940  H      3.135618   23.686543   25.838989     2  8938
8942  8941  O      8.307303   -7.728367  -31.519981     1  8942  8943
8943  8942  H      8.310752   -6.839067  -31.165910     2  8941
8944  8943  H      9.019157   -8.172762  -31.059537     2  8941
8945  8944  O     -1.147480   28.940130   10.414916     1  8945  8946
8946  8945  H     -2.038535   28.902642   10.067284     2  8944
8947  8946  H     -0.889614   28.023614   10.513586     2  8944
8948  8947  O    -11.518366   29.053743   12.455370     1  8948  8949
8949  8948  H    -12.365581   29.487669   12.556205     2  8947
8950  8949  H    -11.725363   28.119204   12.459671     2  8947
8951  8950  O     -0.840712   26.407480   20.584311     1  8951  8952
8952  8951  H     -0.917652   25.619137   21.121737     2  8950
8953  8952  H     -1.673589   26.863223   20.706160     2  8950
8954  8953  O    -14.048618   24.740899   11.398729     1  8954  8955
8955  8954  H    -14.312915   24.289640   12.200443     2  8953
8956  8955  H    -14.388243   24.192471   10.691542     2  8953
8957  8956  O    -32.433041    4.738835   -0.412606     1  8957  8958
8958  8957  H    -31.815766    4.512120   -1.108166     2  8956
8959  8958  H    -32.004133    4.449313    0.392656     2  8956
8960  8959  O    -23.408836   -3.259601    9.923505     1  8960  8961
8961  8960  H    -22.939304   -3.731014    9.235362     2  8959
8962  8961  H    -24.310552   -3.207768    9.606561     2  8959
8963  8962  O     -3.827904   15.909686    4.904235     1  8963  8964
8964  8963  H     -3.463765   16.746556    5.192823     2  8962
8965  8964  H     -4.578448   16.149234    4.360607     2  8962
8966  8965  O    -30.531093   13.462680   -0.667424     1  8966  8967
8967  8966  H    -30.392186   13.411738    0.278272     2  8965
8968  8967  H    -31.479183   13.386850   -0.775157     2  8965
8969  8968  O    -29.867866    7.407979   -1.656826     1  8969  8970
8970  8969  H    -30.707705    7.858053   -1.565521     2  8968
8971  8970  H    -29.580904    7.250574   -0.757322     2  8968
8972  8971  O    -22.291308    0.916736   14.411658     1  8972  8973
8973  8972  H    -22.147993    0.677689   15.327382     2  8971
8974  8973  H    -23.009706    0.352390   14.125913     2  8971
8975  8974  O    -21.335537    5.600216   16.897394     1  8975  8976
8976  8975  H    -21.878948    5.573902   17.684950     2  8974
8977  8976  H    -21.760412    6.247118   16.334163     2  8974
8978  8977  O    -22.392147   -2.717081    1.460933     1  8978  8979
8979  8978  H    -22.886190   -2.072666    0.954097     2  8977
8980  8979  H    -22.722043   -2.623585    2.354611     2  8977
8981  8980  O    -12.606840   18.228016   13.476464     1  8981  8982
8982  8981  H    -13.324217   18.479823   14.058009     2  8980
8983  8982  H    -12.560909   17.274817   13.550846     2  8980
8984  8983  O    -26.335370   22.640929    1.819090     1  8984  8985
8985  8984  H    -26.197395   22.661826    0.872117     2  8983
8986  8985  H    -26.759850   21.798457    1.981231     2  8983
8987  8986  O    -10.060656   12.678142   27.675101     1  8987  8988
8988  8987  H    -10.650462   12.421942   26.966073     2  8986
8989  8988  H     -9.978803   13.627835   27.587836     2  8986
8990  8989  O    -14.621031   12.780426   22.059905     1  8990  8991
8991  8990  H    -14.980131   13.610887   22.372336     2  8989
8992  8991  H    -15.198713   12.114037   22.431981     2  8989
8993  8992  O    -24.295575    3.097810    8.950713     1  8993  8994
8994  8993  H    -24.424891    4.011166    9.206233     2  8992
8995  8994  H    -23.521716    3.113412    8.387570     2  8992
8996  8995  O     -2.620993  -25.203548  -20.516231     1  8996  8997
8997  8996  H     -3.199086  -25.048021  -19.769336     2  8995
8998  8997  H     -3.098559  -24.850548  -21.266933     2  8995
8999  8998  O    -11.124264   32.927621    6.259168     1  8999  9000
9000  8999  H    -10.472808   32.398803    6.719808     2  8998
9001  9000  H    -11.729584   33.212605    6.943713     2  8998
9002  9001  O     -6.625974   23.603493    8.158093     1  9002  9003
9003  9002  H     -6.131216   24.263967    8.643086     2  9001
9004  9003  H     -6.510936   23.844488    7.238898     2  9001
9005  9004  O     -4.241407   26.632207   13.125410     1  9005  9006
9006  9005  H     -5.193656   26.538710   13.152085     2  9004
9007  9006  H     -3.942260   25.891810   12.597626     2  9004
9008  9007  O     -5.421877   18.994551   13.139918     1  9008  9009
9009  9008  H     -6.117589   19.162685   12.504350     2  9007
9010  9009  H     -5.060727   18.146541   12.881691     2  9007
9011  9010  O      3.868753   27.308045   17.295816     1  9011  9012
9012  9011  H      3.608559   27.452993   16.386135     2  9010
9013  9012  H      3.085513   26.952434   17.715705     2  9010
9014  9013  O     -5.828901   22.067849   17.772641     1  9014  9015
9015  9014  H     -4.893927   21.882851   17.684141     2  9013
9016  9015  H     -6.230559   21.641862   17.015385     2  9013
9017  9016  O     -9.010271   23.796350   16.130403     1  9017  9018
9018  9017  H     -8.467348   23.357211   15.475709     2  9016
9019  9018  H     -9.037986   24.709780   15.845606     2  9016
9020  9019  O    -26.054895   16.301561    7.158945     1  9020  9021
9021  9020  H    -25.593881   15.816225    7.843157     2  9019
9022  9021  H    -26.393872   17.078848    7.602963     2  9019
9023  9022  O      4.663422    7.500436   13.294859     1  9023  9024
9024  9023  H      5.154152    6.679823   13.250018     2  9022
9025  9024  H      4.718556    7.763132   14.213653     2  9022
9026  9025  O    -25.616125   14.324943    9.167840     1  9026  9027
9027  9026  H    -24.687890   14.102322    9.238912     2  9025
9028  9027  H    -25.741593   15.034741    9.797663     2  9025
9029  9028  O      3.117500   14.806632   13.157591     1  9029  9030
9030  9029  H      2.325318   14.343125   12.885855     2  9028
9031  9030  H      3.131718   15.595589   12.615764     2  9028
9032  9031  O    -11.022192    3.983049    8.249757     1  9032  9033
9033  9032  H    -11.901342    3.632593    8.392959     2  9031
9034  9033  H    -10.650427    3.426352    7.565570     2  9031
9035  9034  O    -26.441132    3.893827   11.338084     1  9035  9036
9036  9035  H    -27.336454    3.761165   11.649584     2  9034
9037  9036  H    -25.979451    3.092984   11.586546     2  9034
9038  9037  O     -6.628994   -6.372770    9.896803     1  9038  9039
9039  9038  H     -6.358001   -5.460134    9.797359     2  9037
9040  9039  H     -7.558834   -6.373133    9.669583     2  9037
9041  9040  O    -17.657487   19.967658    6.826727     1  9041  9042
9042  9041  H    -18.113579   20.793350    6.989346     2  9040
9043  9042  H    -18.163933   19.546484    6.132209     2  9040
9044  9043  O    -15.809694   29.009363    1.874444     1  9044  9045
9045  9044  H    -14.924387   28.645411    1.875244     2  9043
9046  9045  H    -16.055502   29.044641    2.798872     2  9043
9047  9046  O    -20.389706   -0.808212    2.142503     1  9047  9048
9048  9047  H    -21.268442   -1.131970    1.944422     2  9046
9049  9048  H    -19.802402   -1.475313    1.787142     2  9046
9050  9049  O    -17.426499   16.994012    3.501177     1  9050  9051
9051  9050  H    -17.163819   17.447531    2.700208     2  9049
9052  9051  H    -16.896623   16.196905    3.510416     2  9049
9053  9052  O    -17.877060    2.056384   23.341993     1  9053  9054
9054  9053  H    -17.882531    1.766120   22.429882     2  9052
9055  9054  H    -18.055060    1.263178   23.847336     2  9052
9056  9055  O     -3.765700   27.091675   17.205061     1  9056  9057
9057  9056  H     -3.024752   26.499014   17.331476     2  9055
9058  9057  H     -4.536941   26.552337   17.379799     2  9055
9059  9058  O    -16.913725   -4.585860    9.707495     1  9059  9060
9060  9059  H    -16.237620   -4.095287    9.240107     2  9058
9061  9060  H    -17.375241   -3.925552   10.224435     2  9058
9062  9061  O    -11.454709    2.336687    3.154531     1  9062  9063
9063  9062  H    -12.284551    2.103712    3.570842     2  9061
9064  9063  H    -11.692009    2.987452    2.493906     2  9061
9065  9064  O     -8.226886   25.479805    6.008339     1  9065  9066
9066  9065  H     -7.358885   25.679604    5.657789     2  9064
9067  9066  H     -8.411471   24.592356    5.700779     2  9064
9068  9067  O     -8.420899   29.332395    3.210480     1  9068  9069
9069  9068  H     -7.488442   29.166789    3.071449     2  9067
9070  9069  H     -8.833243   28.473255    3.120585     2  9067
9071  9070  O     -1.838589   16.085086    2.290992     1  9071  9072
9072  9071  H     -2.215603   16.437162    3.097302     2  9070
9073  9072  H     -2.384720   15.327377    2.081588     2  9070
9074  9073  O    -25.987619   18.123250    4.609863     1  9074  9075
9075  9074  H    -25.849042   17.346029    5.151118     2  9073
9076  9075  H    -26.009614   18.849138    5.233428     2  9073
9077  9076  O    -33.806220    2.953823   14.321856     1  9077  9078
9078  9077  H    -34.194347    3.732583   13.922954     2  9076
9079  9078  H    -34.536236    2.341348   14.412312     2  9076
9080  9079  O    -14.371342   17.827051    7.679236     1  9080  9081
9081  9080  H    -14.814970   17.434664    6.927266     2  9079
9082  9081  H    -13.728524   17.170703    7.947980     2  9079
9083  9082  O     -1.335117   25.709387   17.647785     1  9083  9084
9084  9083  H     -0.615695   25.874273   17.038297     2  9082
9085  9084  H     -1.117351   26.228270   18.422104     2  9082
9086  9085  O     -3.613144   36.002252   11.020801     1  9086  9087
9087  9086  H     -4.093820   36.820583   11.145364     2  9085
9088  9087  H     -3.268395   36.059681   10.129689     2  9085
9089  9088  O     21.038819   -8.821002  -22.797076     1  9089  9090
9090  9089  H     21.490525   -8.640770  -21.972631     2  9088
9091  9090  H     20.539484   -9.619837  -22.627493     2  9088
9092  9091  O    -14.732163   21.829203    7.761103     1  9092  9093
9093  9092  H    -14.398528   22.420068    7.085975     2  9091
9094  9093  H    -14.624363   20.954034    7.388692     2  9091
9095  9094  O     -5.758330   28.785372    2.595143     1  9095  9096
9096  9095  H     -5.182566   29.394200    3.057806     2  9094
9097  9096  H     -5.404097   28.748235    1.706677     2  9094
9098  9097  O     -1.935461   16.107522    9.211079     1  9098  9099
9099  9098  H     -1.421821   15.353602    8.921236     2  9097
9100  9099  H     -2.234828   16.519793    8.400744     2  9097
9101  9100  O     18.311356   -8.619929  -18.999520     1  9101  9102
9102  9101  H     17.681355   -7.925833  -18.805718     2  9100
9103  9102  H     19.134177   -8.309592  -18.621513     2  9100
9104  9103  O    -26.957075    4.067462    5.988385     1  9104  9105
9105  9104  H    -26.452516    3.256741    6.054588     2  9103
9106  9105  H    -27.254098    4.238930    6.882034     2  9103
9107  9106  O     -2.293981   24.888236    5.875406     1  9107  9108
9108  9107  H     -1.916473   24.979627    6.750258     2  9106
9109  9108  H     -2.344809   25.783760    5.541212     2  9106
9110  9109  O     -7.745586   17.027148   21.400626     1  9110  9111
9111  9110  H     -8.015846   17.492522   20.609034     2  9109
9112  9111  H     -6.845660   16.753734   21.222835     2  9109
9113  9112  O    -12.623945    0.621592   19.614503     1  9113  9114
9114  9113  H    -13.395505    1.120188   19.883442     2  9112
9115  9114  H    -12.369091    0.133062   20.397203     2  9112
9116  9115  O     -1.335819    1.207870   24.386434     1  9116  9117
9117  9116  H     -0.706538    1.861716   24.690940     2  9115
9118  9117  H     -1.562214    0.708905   25.171297     2  9115
9119  9118  O    -18.235080   22.215814   12.496085     1  9119  9120
9120  9119  H    -18.209519   22.981685   11.922483     2  9118
9121  9120  H    -18.530427   21.502210   11.930602     2  9118
9122  9121  O      0.611207   22.526202   26.552196     1  9122  9123
9123  9122  H      0.686473   23.078626   27.330267     2  9121
9124  9123  H      1.499715   22.487913   26.198194     2  9121
9125  9124  O     -9.559119   30.177320   10.190606     1  9125  9126
9126  9125  H     -9.930443   29.821197    9.383435     2  9124
9127  9126  H     -9.748693   29.514631   10.854787     2  9124
9128  9127  O     -1.279257   24.893659    8.654143     1  9128  9129
9129  9128  H     -0.829326   25.668214    8.316712     2  9127
9130  9129  H     -0.920142   24.771323    9.532950     2  9127
9131  9130  O     -7.735969   -4.009209   13.447362     1  9131  9132
9132  9131  H     -8.078372   -4.154223   12.565340     2  9130
9133  9132  H     -8.483564   -4.166925   14.023953     2  9130
9134  9133  O     17.023534  -16.411741  -10.768304     1  9134  9135
9135  9134  H     16.269724  -15.858690  -10.563029     2  9133
9136  9135  H     16.679899  -17.072160  -11.369962     2  9133
9137  9136  O    -15.429280   25.461943    7.405173     1  9137  9138
9138  9137  H    -14.566672   25.754989    7.111466     2  9136
9139  9138  H    -15.626745   24.705612    6.852722     2  9136
9140  9139  O     -9.845616   10.848540    8.430430     1  9140  9141
9141  9140  H     -8.892384   10.830368    8.345275     2  9139
9142  9141  H    -10.017523   10.457694    9.287120     2  9139
9143  9142  O     30.813805   -7.461566  -10.586063     1  9143  9144
9144  9143  H     30.342867   -7.322305  -11.407681     2  9142
9145  9144  H     31.584913   -6.898413  -10.653007     2  9142
9146  9145  O     -1.001151   15.113226   25.204315     1  9146  9147
9147  9146  H     -0.956029   14.636402   24.375561     2  9145
9148  9147  H     -0.956241   16.035792   24.953144     2  9145
9149  9148  O     20.961005    2.213900  -28.495819     1  9149  9150
9150  9149  H     21.630641    1.796245  -27.954170     2  9148
9151  9150  H     20.208194    1.625046  -28.443282     2  9148
9152  9151  O    -21.332756   27.402836   -0.392481     1  9152  9153
9153  9152  H    -21.800339   26.837221   -1.007036     2  9151
9154  9153  H    -21.978625   27.608583    0.283355     2  9151
9155  9154  O    -12.349616   24.390679    1.826940     1  9155  9156
9156  9155  H    -12.750964   23.541732    2.012521     2  9154
9157  9156  H    -11.407753   24.223706    1.862219     2  9154
9158  9157  O     -8.632148   30.986365    5.264765     1  9158  9159
9159  9158  H     -8.634105   30.330355    4.567716     2  9157
9160  9159  H     -7.921427   31.583246    5.030586     2  9157
9161  9160  O    -10.265239   22.609752   12.234314     1  9161  9162
9162  9161  H     -9.849767   23.049438   11.492498     2  9160
9163  9162  H    -11.049044   23.129336   12.412959     2  9160
9164  9163  O    -13.027711   29.288637    9.663335     1  9164  9165
9165  9164  H    -12.282875   28.748737    9.398839     2  9163
9166  9165  H    -13.726608   28.660552    9.845774     2  9163
9167  9166  O     -6.626152   26.437635   20.819024     1  9167  9168
9168  9167  H     -6.555375   26.191158   21.741234     2  9166
9169  9168  H     -7.566829   26.436930   20.641937     2  9166
9170  9169  O     -5.894812    8.147317    8.909722     1  9170  9171
9171  9170  H     -5.464395    8.522854    9.677800     2  9169
9172  9171  H     -5.849916    7.201230    9.048056     2  9169
9173  9172  O    -15.525068    5.745386   29.713101     1  9173  9174
9174  9173  H    -16.443411    5.475796   29.698969     2  9172
9175  9174  H    -15.033980    4.929846   29.613316     2  9172
9176  9175  O     -4.981969   28.474770    7.551993     1  9176  9177
9177  9176  H     -4.761536   28.931585    8.363757     2  9175
9178  9177  H     -4.289438   28.724705    6.940304     2  9175
9179  9178  O    -22.895656   21.423726    5.057194     1  9179  9180
9180  9179  H    -23.806337   21.549564    4.790631     2  9178
9181  9180  H    -22.477901   22.268695    4.890644     2  9178
9182  9181  O    -22.565144   26.290894    3.228619     1  9182  9183
9183  9182  H    -22.899772   26.826261    2.509148     2  9181
9184  9183  H    -21.894602   26.835335    3.641158     2  9181
9185  9184  O     -7.926691   -0.164222   -0.145866     1  9185  9186
9186  9185  H     -8.647439    0.187050    0.376976     2  9184
9187  9186  H     -7.139587    0.053960    0.353228     2  9184
9188  9187  O    -29.708910   17.173805    7.357540     1  9188  9189
9189  9188  H    -30.312816   16.467894    7.588232     2  9187
9190  9189  H    -29.482445   17.006509    6.442687     2  9187
9191  9190  O     -6.627368    5.779742   35.236639     1  9191  9192
9192  9191  H     -5.774539    6.174844   35.055504     2  9190
9193  9192  H     -6.760407    5.915583   36.174764     2  9190
9194  9193  O    -18.251422   22.918776    6.611263     1  9194  9195
9195  9194  H    -18.672427   22.420462    5.910786     2  9193
9196  9195  H    -17.389516   23.143905    6.261023     2  9193
9197  9196  O    -27.726796   14.101297    0.667478     1  9197  9198
9198  9197  H    -28.395035   14.431531    1.268005     2  9196
9199  9198  H    -27.062765   13.713195    1.237277     2  9196
9200  9199  O    -16.442017   14.328893   11.362949     1  9200  9201
9201  9200  H    -16.425993   13.556759   11.928442     2  9199
9202  9201  H    -17.123738   14.886660   11.737629     2  9199
9203  9202  O    -20.466838    8.949347   -2.156106     1  9203  9204
9204  9203  H    -20.617908    9.776248   -1.698236     2  9202
9205  9204  H    -20.654731    9.145453   -3.073968     2  9202
9206  9205  O     -6.152579   29.595057   12.091727     1  9206  9207
9207  9206  H     -7.040326   29.761660   12.408557     2  9205
9208  9207  H     -6.275542   29.216461   11.221224     2  9205
9209  9208  O    -10.102142   22.466128    4.994462     1  9209  9210
9210  9209  H     -9.670236   21.929049    5.658718     2  9208
9211  9210  H    -10.549731   21.835808    4.430023     2  9208
9212  9211  O    -16.459569   29.473615    7.607803     1  9212  9213
9213  9212  H    -15.546896   29.630727    7.365779     2  9211
9214  9213  H    -16.882579   30.327350    7.515988     2  9211
9215  9214  O    -17.173745    6.868979   16.394102     1  9215  9216
9216  9215  H    -17.379243    7.198817   17.268864     2  9214
9217  9216  H    -17.110990    7.654126   15.850192     2  9214
9218  9217  O     -1.762876    9.027026   27.694930     1  9218  9219
9219  9218  H     -2.474303    9.484251   28.143314     2  9217
9220  9219  H     -1.899158    9.221836   26.767726     2  9217
9221  9220  O    -14.196039   20.392143   11.912788     1  9221  9222
9222  9221  H    -14.172404   20.072284   12.814654     2  9220
9223  9222  H    -14.398496   19.617268   11.388563     2  9220
9224  9223  O     -4.055767    4.982894   25.685479     1  9224  9225
9225  9224  H     -3.234810    5.452366   25.833321     2  9223
9226  9225  H     -4.427496    4.868206   26.560063     2  9223
9227  9226  O    -10.446356   19.948221   14.610385     1  9227  9228
9228  9227  H    -10.721979   19.089221   14.290412     2  9226
9229  9228  H    -10.438064   20.503415   13.830691     2  9226
9230  9229  O    -21.633293    5.430197    0.814498     1  9230  9231
9231  9230  H    -21.539293    5.436988    1.767046     2  9229
9232  9231  H    -21.685973    6.354657    0.571946     2  9229
9233  9232  O      0.563200   18.347631   26.219459     1  9233  9234
9234  9233  H      1.075023   18.932731   25.660956     2  9232
9235  9234  H     -0.348113   18.552542   26.010289     2  9232
9236  9235  O    -29.080647    6.687798   12.276233     1  9236  9237
9237  9236  H    -29.048342    6.905589   13.207767     2  9235
9238  9237  H    -28.207512    6.903856   11.948840     2  9235
9239  9238  O    -10.762263   15.660693    1.737124     1  9239  9240
9240  9239  H    -10.620176   15.231979    2.581072     2  9238
9241  9240  H    -10.111978   15.266977    1.155447     2  9238
9242  9241  O     -1.953833   31.097279    8.383303     1  9242  9243
9243  9242  H     -1.481713   31.884356    8.111561     2  9241
9244  9243  H     -1.355742   30.654529    8.985376     2  9241
9245  9244  O     33.138800   10.410630    0.362985     1  9245  9246
9246  9245  H     33.261949   10.933282   -0.429417     2  9244
9247  9246  H     32.389488   10.813202    0.801959     2  9244
9248  9247  O    -31.506352   15.021880    7.542894     1  9248  9249
9249  9248  H    -32.264182   15.320309    8.045752     2  9247
9250  9249  H    -31.789839   15.070597    6.629935     2  9247
9251  9250  O     -0.337199   13.753883    7.924446     1  9251  9252
9252  9251  H      0.385372   13.348331    7.445229     2  9250
9253  9252  H     -0.982870   13.966298    7.250487     2  9250
9254  9253  O     -3.741423   -0.484273   29.714660     1  9254  9255
9255  9254  H     -4.262034   -0.694425   28.939397     2  9253
9256  9255  H     -3.923750   -1.197303   30.326687     2  9253
9257  9256  O      7.206021  -21.364823  -24.545444     1  9257  9258
9258  9257  H      7.305000  -21.841366  -23.721221     2  9256
9259  9258  H      6.933707  -22.030957  -25.176588     2  9256
9260  9259  O     19.787831   -7.591470  -25.056199     1  9260  9261
9261  9260  H     20.404685   -8.041438  -25.633478     2  9259
9262  9261  H     19.702959   -8.169782  -24.298186     2  9259
9263  9262  O      2.805790   26.201661   22.376564     1  9263  9264
9264  9263  H      2.763485   27.013249   21.870830     2  9262
9265  9264  H      2.898969   26.489388   23.284728     2  9262
9266  9265  O      8.813464   -5.633138  -36.004254     1  9266  9267
9267  9266  H      9.534359   -6.213179  -36.249396     2  9265
9268  9267  H      8.391154   -6.073637  -35.266795     2  9265
9269  9268  O    -26.495323    7.828184   18.216418     1  9269  9270
9270  9269  H    -25.861374    8.353919   17.728624     2  9268
9271  9270  H    -26.428087    6.953939   17.832482     2  9268
9272  9271  O    -20.998964   -3.060145   11.372042     1  9272  9273
9273  9272  H    -21.910380   -3.219191   11.126569     2  9271
9274  9273  H    -20.959368   -2.120902   11.552282     2  9271
9275  9274  O    -13.594111   13.185737   10.883777     1  9275  9276
9276  9275  H    -13.699808   12.900398    9.976231     2  9274
9277  9276  H    -14.395943   12.898514   11.320584     2  9274
9278  9277  O     30.414949    2.719532   -2.509307     1  9278  9279
9279  9278  H     30.264145    2.839723   -3.446880     2  9277
9280  9279  H     30.628256    1.790915   -2.417648     2  9277
9281  9280  O     -6.350842   21.815318   10.173597     1  9281  9282
9282  9281  H     -6.580682   22.399589    9.451078     2  9280
9283  9282  H     -7.068648   21.183051   10.208588     2  9280
9284  9283  O    -16.313297    1.310669    4.074097     1  9284  9285
9285  9284  H    -16.515214    2.211768    3.822138     2  9283
9286  9285  H    -17.081900    1.020932    4.565558     2  9283
9287  9286  O     15.663919    0.298613  -22.230954     1  9287  9288
9288  9287  H     16.133364    0.635104  -21.467654     2  9286
9289  9288  H     16.146574    0.645038  -22.981465     2  9286
9290  9289  O    -10.279655   27.251321    6.171481     1  9290  9291
9291  9290  H    -10.957706   26.632703    5.899840     2  9289
9292  9291  H     -9.455617   26.802988    5.981241     2  9289
9293  9292  O    -22.059903   18.959165    3.863800     1  9293  9294
9294  9293  H    -22.757633   18.811523    3.225360     2  9292
9295  9294  H    -22.393812   19.657353    4.427067     2  9292
9296  9295  O      0.504827  -16.679606  -32.570096     1  9296  9297
9297  9296  H     -0.043769  -17.369404  -32.196662     2  9295
9298  9297  H      1.021105  -16.357241  -31.831334     2  9295
9299  9298  O     -8.135140   26.251266    9.118418     1  9299  9300
9300  9299  H     -7.680596   25.912222    8.347270     2  9298
9301  9300  H     -7.849483   27.162488    9.184054     2  9298
9302  9301  O     34.805171   10.835270    7.019743     1  9302  9303
9303  9302  H     34.906599   10.203821    6.307552     2  9301
9304  9303  H     34.468864   10.318917    7.752210     2  9301
9305  9304  O     -4.397372   22.809181    0.413287     1  9305  9306
9306  9305  H     -5.027346   22.127874    0.648202     2  9304
9307  9306  H     -3.552951   22.358840    0.393823     2  9304
9308  9307  O      1.209058   25.717949   15.822450     1  9308  9309
9309  9308  H      1.785928   25.725861   15.058650     2  9307
9310  9309  H      1.639294   25.128680   16.442040     2  9307
9311  9310  O    -31.608734    0.423882   14.912501     1  9311  9312
9312  9311  H    -32.542117    0.383801   15.120880     2  9310
9313  9312  H    -31.549043    0.097409   14.014679     2  9310
9314  9313  O    -15.205322   19.930757    5.595568     1  9314  9315
9315  9314  H    -15.469326   19.772906    4.689137     2  9313
9316  9315  H    -16.023578   20.121740    6.054060     2  9313
9317  9316  O      5.862525   -9.444711  -34.539465     1  9317  9318
9318  9317  H      5.313786   -8.736069  -34.875534     2  9316
9319  9318  H      6.744010   -9.231511  -34.845669     2  9316
9320  9319  O    -10.636764   14.333732    4.001156     1  9320  9321
9321  9320  H    -10.650317   13.381813    3.901665     2  9319
9322  9321  H    -10.176619   14.482157    4.827272     2  9319
9323  9322  O    -17.087307   -6.383356    5.922589     1  9323  9324
9324  9323  H    -17.886490   -5.857473    5.891201     2  9322
9325  9324  H    -16.479303   -5.931098    5.337760     2  9322
9326  9325  O     19.192932  -17.368156   -4.128186     1  9326  9327
9327  9326  H     18.539538  -17.769542   -4.701070     2  9325
9328  9327  H     18.734959  -17.234807   -3.298300     2  9325
9329  9328  O     -6.708274   21.303564   23.622403     1  9329  9330
9330  9329  H     -6.393304   20.687978   22.960527     2  9328
9331  9330  H     -7.271981   21.907760   23.139276     2  9328
9332  9331  O    -15.207200    6.402298    8.367558     1  9332  9333
9333  9332  H    -15.851749    6.480606    9.070876     2  9331
9334  9333  H    -14.363873    6.542134    8.798229     2  9331
9335  9334  O    -22.629107    8.161563   15.294283     1  9335  9336
9336  9335  H    -22.983767    8.486983   16.121658     2  9334
9337  9336  H    -22.464745    8.949995   14.776990     2  9334
9338  9337  O    -24.256620   15.648370    4.965347     1  9338  9339
9339  9338  H    -23.327722   15.543374    5.171157     2  9337
9340  9339  H    -24.712872   15.309693    5.735648     2  9337
9341  9340  O    -11.888340   -1.484175   13.322050     1  9341  9342
9342  9341  H    -12.628441   -1.690870   13.892804     2  9340
9343  9342  H    -11.355493   -0.873708   13.831594     2  9340
9344  9343  O     13.100745  -10.571966  -25.356778     1  9344  9345
9345  9344  H     12.742323  -10.351402  -24.497058     2  9343
9346  9345  H     12.773699   -9.884286  -25.936750     2  9343
9347  9346  O    -15.996643   22.989070    0.348824     1  9347  9348
9348  9347  H    -16.053891   23.930695    0.186660     2  9346
9349  9348  H    -16.230448   22.889835    1.271710     2  9346
9350  9349  O    -29.301713    4.151501   10.617433     1  9350  9351
9351  9350  H    -29.837078    3.467980   11.020440     2  9349
9352  9351  H    -29.552519    4.953890   11.075144     2  9349
9353  9352  O    -19.700001    6.183611   26.170098     1  9353  9354
9354  9353  H    -18.755175    6.199767   26.017539     2  9352
9355  9354  H    -19.920097    5.253104   26.214211     2  9352
9356  9355  O     -5.728856   25.005718    1.252466     1  9356  9357
9357  9356  H     -5.252599   24.205428    1.031225     2  9355
9358  9357  H     -6.373766   25.102667    0.551806     2  9355
9359  9358  O     -3.591628   27.145398   -2.213422     1  9359  9360
9360  9359  H     -3.078423   27.856575   -2.596931     2  9358
9361  9360  H     -3.434519   26.397915   -2.790326     2  9358
9362  9361  O    -15.466362   22.344819   10.223311     1  9362  9363
9363  9362  H    -15.092294   22.178109    9.358145     2  9361
9364  9363  H    -15.078188   21.674627   10.785801     2  9361
9365  9364  O    -19.968401   14.362423   15.990533     1  9365  9366
9366  9365  H    -20.906513   14.530385   15.901282     2  9364
9367  9366  H    -19.696280   14.055127   15.125807     2  9364
9368  9367  O     -0.043189   22.853411   16.875504     1  9368  9369
9369  9368  H     -0.427675   23.720521   17.004034     2  9367
9370  9369  H     -0.230932   22.384703   17.688707     2  9367
9371  9370  O     -7.507932   34.320195    6.975542     1  9371  9372
9372  9371  H     -7.415350   34.809358    7.793087     2  9370
9373  9372  H     -8.065921   33.576394    7.202788     2  9370
9374  9373  O     23.006504   -3.639265  -24.469333     1  9374  9375
9375  9374  H     23.897233   -3.836699  -24.758906     2  9373
9376  9375  H     22.697700   -4.453059  -24.071074     2  9373
9377  9376  O     -2.958124   29.974174    5.944069     1  9377  9378
9378  9377  H     -2.369456   30.264583    6.640749     2  9376
9379  9378  H     -2.914067   30.669203    5.287392     2  9376
9380  9379  O    -20.389985   19.143796   14.616314     1  9380  9381
9381  9380  H    -21.257032   18.893563   14.935448     2  9379
9382  9381  H    -20.388348   20.100365   14.650996     2  9379
9383  9382  O     17.262625   -2.864645  -26.618492     1  9383  9384
9384  9383  H     17.514834   -3.349087  -25.832403     2  9382
9385  9384  H     16.323442   -2.711485  -26.515003     2  9382
9386  9385  O     -6.374693   24.698323   11.630432     1  9386  9387
9387  9386  H     -6.337832   25.145775   10.785056     2  9385
9388  9387  H     -6.144703   23.790651   11.431767     2  9385
9389  9388  O     -6.112074   21.342393   -1.591663     1  9389  9390
9390  9389  H     -6.008994   22.245670   -1.891158     2  9388
9391  9390  H     -6.458863   20.875568   -2.351955     2  9388
9392  9391  O     -4.137550   20.944738    7.015526     1  9392  9393
9393  9392  H     -4.844996   20.300387    6.991809     2  9391
9394  9393  H     -4.115481   21.243555    7.924621     2  9391
9395  9394  O     14.551861   -0.897839  -29.570962     1  9395  9396
9396  9395  H     15.481211   -0.714659  -29.708748     2  9394
9397  9396  H     14.113999   -0.065946  -29.751133     2  9394
9398  9397  O     -3.684302   29.612968   18.204958     1  9398  9399
9399  9398  H     -4.579226   29.540013   18.536651     2  9397
9400  9399  H     -3.618103   28.927418   17.540225     2  9397
9401  9400  O    -14.740680   27.174241    9.803159     1  9401  9402
9402  9401  H    -14.488564   26.513789   10.448505     2  9400
9403  9402  H    -14.636056   26.736518    8.958360     2  9400
9404  9403  O     -0.421536  -32.464976  -19.183034     1  9404  9405
9405  9404  H      0.417237  -32.508631  -19.642149     2  9403
9406  9405  H     -0.780674  -31.609963  -19.420109     2  9403
9407  9406  O     -8.617903   20.765394   16.309074     1  9407  9408
9408  9407  H     -8.110890   19.953628   16.323359     2  9406
9409  9408  H     -9.202319   20.670127   15.557001     2  9406
9410  9409  O     -9.157326   28.844115   -0.010062     1  9410  9411
9411  9410  H     -8.230006   29.011735   -0.178027     2  9409
9412  9411  H     -9.389426   29.456894    0.687694     2  9409
9413  9412  O     21.679280   -1.173019  -29.736242     1  9413  9414
9414  9413  H     22.052426   -1.950597  -30.151413     2  9412
9415  9414  H     21.035022   -1.517097  -29.117556     2  9412
9416  9415  O      2.216289   11.669524  -34.537930     1  9416  9417
9417  9416  H      3.030895   12.165599  -34.456945     2  9415
9418  9417  H      1.624920   12.073911  -33.903119     2  9415
9419  9418  O    -21.498591   21.742630    1.354150     1  9419  9420
9420  9419  H    -21.762488   22.277028    2.103155     2  9418
9421  9420  H    -22.066679   22.032602    0.640412     2  9418
9422  9421  O     -9.664877   15.710118    6.703077     1  9422  9423
9423  9422  H     -8.810680   15.356023    6.950454     2  9421
9424  9423  H     -9.462711   16.523304    6.240381     2  9421
9425  9424  O    -23.224970   15.910092    8.960797     1  9425  9426
9426  9425  H    -22.881307   16.657008    8.470651     2  9424
9427  9426  H    -22.483656   15.308873    9.033055     2  9424
9428  9427  O    -10.090468   19.759489    3.512816     1  9428  9429
9429  9428  H    -11.033704   19.614346    3.586781     2  9427
9430  9429  H     -9.703470   18.893825    3.643540     2  9427
9431  9430  O      4.660849   19.674721   27.614683     1  9431  9432
9432  9431  H      5.508296   20.017600   27.898406     2  9430
9433  9432  H      4.817263   19.352766   26.726926     2  9430
9434  9433  O    -20.236338   -1.843697   16.699515     1  9434  9435
9435  9434  H    -19.644014   -1.093286   16.747149     2  9433
9436  9435  H    -19.723765   -2.576125   17.041640     2  9433
9437  9436  O      0.605050  -32.070420  -16.701192     1  9437  9438
9438  9437  H      0.279889  -32.286720  -17.575101     2  9436
9439  9438  H      1.115956  -32.836192  -16.438894     2  9436
9440  9439  O    -16.631285   27.813088    4.886612     1  9440  9441
9441  9440  H    -17.008769   27.638790    5.748793     2  9439
9442  9441  H    -16.647971   28.766713    4.805655     2  9439
9443  9442  O    -28.911446    8.449581    8.219123     1  9443  9444
9444  9443  H    -29.240044    8.880157    9.008337     2  9442
9445  9444  H    -29.699292    8.200623    7.735852     2  9442
9446  9445  O     23.285846  -10.114706  -20.427866     1  9446  9447
9447  9446  H     23.365622  -10.666666  -19.649916     2  9445
9448  9447  H     22.564303   -9.518868  -20.226407     2  9445
9449  9448  O    -17.247717   10.434198    5.740141     1  9449  9450
9450  9449  H    -16.999998   11.344248    5.903464     2  9448
9451  9450  H    -16.415558    9.963319    5.695239     2  9448
9452  9451  O     -0.206460   13.986926   27.566525     1  9452  9453
9453  9452  H     -0.639252   13.173796   27.306250     2  9451
9454  9453  H     -0.430284   14.609882   26.875106     2  9451
9455  9454  O    -12.440852   31.856959    8.736381     1  9455  9456
9456  9455  H    -12.695472   31.015708    9.115455     2  9454
9457  9456  H    -12.190380   32.393201    9.488670     2  9454
9458  9457  O    -10.194517    5.562842   29.718426     1  9458  9459
9459  9458  H     -9.912197    4.941650   29.047122     2  9457
9460  9459  H    -10.512899    6.319660   29.226399     2  9457
9461  9460  O    -15.235057   17.468116   11.254220     1  9461  9462
9462  9461  H    -15.626622   16.667522   11.603445     2  9460
9463  9462  H    -15.790636   17.702505   10.510832     2  9460
9464  9463  O     -5.628537   12.799880   23.024714     1  9464  9465
9465  9464  H     -6.566153   12.961596   22.920046     2  9463
9466  9465  H     -5.579858   12.012501   23.566835     2  9463
9467  9466  O    -14.119955   26.345984    1.613053     1  9467  9468
9468  9467  H    -13.409271   25.709488    1.690724     2  9466
9469  9468  H    -14.652089   26.023948    0.885484     2  9466
9470  9469  O    -22.162587    1.379798   28.907887     1  9470  9471
9471  9470  H    -21.943409    1.012276   29.764111     2  9469
9472  9471  H    -22.854789    0.810182   28.572289     2  9469
9473  9472  O     -0.860374    6.487453   28.383817     1  9473  9474
9474  9473  H     -1.453700    6.075587   29.011958     2  9472
9475  9474  H     -1.293288    7.307655   28.146988     2  9472
9476  9475  O     -7.109784    3.020215    1.766032     1  9476  9477
9477  9476  H     -7.684480    2.434386    2.258739     2  9475
9478  9477  H     -7.679262    3.416217    1.106403     2  9475
9479  9478  O    -28.002207   12.624229   -1.825234     1  9479  9480
9480  9479  H    -27.606238   13.175767   -1.150514     2  9478
9481  9480  H    -28.942321   12.669483   -1.650968     2  9478
9482  9481  O     -0.334263    5.608857   25.976594     1  9482  9483
9483  9482  H     -0.772852    6.431747   25.760442     2  9481
9484  9483  H     -0.157712    5.670389   26.915357     2  9481
9485  9484  O    -15.705054   -3.266411    5.384446     1  9485  9486
9486  9485  H    -16.583530   -2.907091    5.260341     2  9484
9487  9486  H    -15.614242   -3.356041    6.333104     2  9484
9488  9487  O      1.548949   22.953062   22.810136     1  9488  9489
9489  9488  H      1.657009   23.516169   22.043674     2  9487
9490  9489  H      2.109916   22.197730   22.634003     2  9487
9491  9490  O    -27.754142    4.592655   -1.955019     1  9491  9492
9492  9491  H    -28.135158    4.956133   -2.754357     2  9490
9493  9492  H    -26.918484    5.049332   -1.858304     2  9490
9494  9493  O      4.757959   14.592107   34.242960     1  9494  9495
9495  9494  H      4.324391   13.793495   34.543740     2  9493
9496  9495  H      4.202611   14.913778   33.532784     2  9493
9497  9496  O     -7.408297   20.494566    3.888304     1  9497  9498
9498  9497  H     -6.944690   20.600588    3.057605     2  9496
9499  9498  H     -8.332459   20.600415    3.662578     2  9496
9500  9499  O    -12.294175    2.974254   29.982229     1  9500  9501
9501  9500  H    -13.164134    2.848916   29.603158     2  9499
9502  9501  H    -11.842797    3.547608   29.362750     2  9499
9503  9502  O     -1.384771    4.988311   31.762920     1  9503  9504
9504  9503  H     -1.023906    5.744498   32.225726     2  9502
9505  9504  H     -2.222073    5.296352   31.416123     2  9502
9506  9505  O      1.012203   24.646228   28.414925     1  9506  9507
9507  9506  H      0.255757   24.910506   28.938545     2  9505
9508  9507  H      1.710603   24.508258   29.054795     2  9505
9509  9508  O    -26.057071    5.069894   18.155849     1  9509  9510
9510  9509  H    -25.860241    5.261531   19.072781     2  9508
9511  9510  H    -25.587447    4.255732   17.974670     2  9508
9512  9511  O    -35.233819    0.274995    7.878923     1  9512  9513
9513  9512  H    -34.390165    0.122633    8.304677     2  9511
9514  9513  H    -35.499777   -0.586698    7.558014     2  9511
9515  9514  O     -9.473271   14.499321   24.334501     1  9515  9516
9516  9515  H    -10.427213   14.421544   24.347831     2  9514
9517  9516  H     -9.271352   15.099340   25.052440     2  9514
9518  9517  O    -25.779822   -0.046895   20.688746     1  9518  9519
9519  9518  H    -26.198113    0.798332   20.524867     2  9517
9520  9519  H    -26.414418   -0.692874   20.378536     2  9517
9521  9520  O    -26.288908    0.319240   23.914745     1  9521  9522
9522  9521  H    -25.634398   -0.248497   23.507901     2  9520
9523  9522  H    -27.122816    0.025147   23.548222     2  9520
9524  9523  O    -29.127998   16.305199    4.807309     1  9524  9525
9525  9524  H    -28.583515   15.980750    4.090021     2  9523
9526  9525  H    -29.488952   17.129401    4.480761     2  9523
9527  9526  O    -13.808727  -34.389133   -0.525851     1  9527  9528
9528  9527  H    -13.908331  -35.306136   -0.781616     2  9526
9529  9528  H    -14.702993  -34.084382   -0.372075     2  9526
9530  9529  O    -19.685243    5.435024   12.795615     1  9530  9531
9531  9530  H    -20.585611    5.124559   12.891432     2  9529
9532  9531  H    -19.266293    4.785637   12.230805     2  9529
9533  9532  O     15.373408  -29.510163   -2.575201     1  9533  9534
9534  9533  H     15.837099  -29.856123   -3.337785     2  9532
9535  9534  H     15.502341  -30.171657   -1.895471     2  9532
9536  9535  O     -7.300029    6.357355   29.628212     1  9536  9537
9537  9536  H     -8.060318    5.794680   29.775142     2  9535
9538  9537  H     -7.010055    6.603191   30.506683     2  9535
9539  9538  O    -14.468880    7.659400   15.016637     1  9539  9540
9540  9539  H    -14.784776    7.181370   14.249872     2  9538
9541  9540  H    -13.786620    7.098136   15.385059     2  9538
9542  9541  O     -3.051616   10.210485   22.562194     1  9542  9543
9543  9542  H     -3.089334   11.165355   22.617264     2  9541
9544  9543  H     -2.184807    9.984689   22.899671     2  9541
9545  9544  O     -2.207605    9.438872   32.093025     1  9545  9546
9546  9545  H     -2.137427   10.324222   31.736008     2  9544
9547  9546  H     -1.647171    9.447878   32.868953     2  9544
9548  9547  O    -10.325890    6.132914   23.135588     1  9548  9549
9549  9548  H    -10.037917    6.251358   24.040726     2  9547
9550  9549  H     -9.574174    6.401688   22.607465     2  9547
9551  9550  O    -11.431917    9.842312   19.609658     1  9551  9552
9552  9551  H    -11.081131    9.554098   20.452341     2  9550
9553  9552  H    -12.249972   10.287824   19.829965     2  9550
9554  9553  O     -1.534436   30.097033    0.561846     1  9554  9555
9555  9554  H     -0.824984   29.919436    1.179396     2  9553
9556  9555  H     -2.333273   30.004813    1.081063     2  9553
9557  9556  O     -2.220552   16.913048   29.364171     1  9557  9558
9558  9557  H     -2.409767   17.678336   28.821250     2  9556
9559  9558  H     -1.276621   16.782299   29.274009     2  9556
9560  9559  O     -8.266145    1.470644   15.451303     1  9560  9561
9561  9560  H     -7.971365    1.815595   16.294123     2  9559
9562  9561  H     -7.477751    1.456857   14.908646     2  9559
9563  9562  O    -24.673221    3.023454   17.265370     1  9563  9564
9564  9563  H    -23.740592    2.825488   17.350491     2  9562
9565  9564  H    -24.769133    3.346815   16.369564     2  9562
9566  9565  O     -5.830759    6.658286   23.405932     1  9566  9567
9567  9566  H     -5.437873    6.949282   24.228849     2  9565
9568  9567  H     -5.548387    7.308003   22.762220     2  9565
9569  9568  O    -17.050703   25.427142    2.597527     1  9569  9570
9570  9569  H    -16.797922   26.299599    2.899440     2  9568
9571  9570  H    -16.919291   25.453743    1.649764     2  9568
9572  9571  O    -18.623252   15.209817    1.647296     1  9572  9573
9573  9572  H    -18.490400   15.814656    2.377195     2  9571
9574  9573  H    -19.399446   15.543466    1.197371     2  9571
9575  9574  O     22.272051   -5.622975  -17.726558     1  9575  9576
9576  9575  H     22.300031   -5.226905  -16.855595     2  9574
9577  9576  H     22.139958   -4.884985  -18.321665     2  9574
9578  9577  O      4.666313  -10.923658  -30.130458     1  9578  9579
9579  9578  H      5.331731  -11.090517  -29.462919     2  9577
9580  9579  H      5.165346  -10.701818  -30.916578     2  9577
9581  9580  O      6.424108  -26.208961  -14.783607     1  9581  9582
9582  9581  H      6.836139  -25.756992  -15.519939     2  9580
9583  9582  H      6.356036  -25.542046  -14.100364     2  9580
9584  9583  O      7.585620   -3.551522  -32.017656     1  9584  9585
9585  9584  H      6.712129   -3.892417  -32.210101     2  9583
9586  9585  H      8.093489   -3.732500  -32.808572     2  9583
9587  9586  O      4.306434   -8.704980  -19.393900     1  9587  9588
9588  9587  H      4.187339   -9.509821  -19.898160     2  9586
9589  9588  H      4.045090   -8.005598  -19.992895     2  9586
9590  9589  O     23.019476  -17.277072   -2.228076     1  9590  9591
9591  9590  H     23.593170  -16.631898   -2.641425     2  9589
9592  9591  H     23.137962  -17.136631   -1.288678     2  9589
9593  9592  O     26.680773  -13.406263  -11.456182     1  9593  9594
9594  9593  H     26.934140  -12.774755  -12.129409     2  9592
9595  9594  H     26.239015  -14.105866  -11.937470     2  9592
9596  9595  O     18.035697  -21.251641  -11.009768     1  9596  9597
9597  9596  H     17.333443  -20.606930  -11.095894     2  9595
9598  9597  H     18.801262  -20.739308  -10.749660     2  9595
9599  9598  O    -34.292866  -14.457022   -5.545428     1  9599  9600
9600  9599  H    -35.159551  -14.119352   -5.771412     2  9598
9601  9600  H    -34.317199  -15.376678   -5.809762     2  9598
9602  9601  O     -2.023153   23.259855   29.012700     1  9602  9603
9603  9602  H     -2.112808   23.514473   28.094352     2  9601
9604  9603  H     -2.060877   24.085543   29.495451     2  9601
9605  9604  O    -28.013293    1.651244   15.183644     1  9605  9606
9606  9605  H    -28.141263    2.542960   14.860074     2  9604
9607  9606  H    -28.748543    1.504000   15.778588     2  9604
9608  9607  O      4.474697   -7.313727   -4.536461     1  9608  9609
9609  9608  H      4.146961   -8.152545   -4.212108     2  9607
9610  9609  H      3.878044   -6.663439   -4.165839     2  9607
9611  9610  O      2.359692  -17.755062    0.844841     1  9611  9612
9612  9611  H      1.745470  -17.691371    1.576214     2  9610
9613  9612  H      3.180825  -17.404403    1.189820     2  9610
9614  9613  O      4.209299   33.917269   -3.987610     1  9614  9615
9615  9614  H      4.464432   34.149543   -4.880463     2  9613
9616  9615  H      4.734847   34.491648   -3.430727     2  9613
9617  9616  O    -21.189305    3.462611   22.796015     1  9617  9618
9618  9617  H    -21.934478    4.062838   22.822006     2  9616
9619  9618  H    -20.495614    3.959867   22.362702     2  9616
9620  9619  O     -9.604172   -4.757315   34.682204     1  9620  9621
9621  9620  H    -10.411035   -5.218175   34.912013     2  9619
9622  9621  H     -9.401170   -5.056265   33.795835     2  9619
9623  9622  O     15.842992  -19.570141  -10.556426     1  9623  9624
9624  9623  H     15.784602  -19.758433   -9.619747     2  9622
9625  9624  H     14.976740  -19.235428  -10.788387     2  9622
9626  9625  O     17.550646  -20.469254    1.637115     1  9626  9627
9627  9626  H     17.826325  -20.630810    2.539408     2  9625
9628  9627  H     17.160662  -21.296160    1.353618     2  9625
9629  9628  O     25.413910   -1.699114  -16.221884     1  9629  9630
9630  9629  H     24.845171   -0.935362  -16.124665     2  9628
9631  9630  H     25.853799   -1.780040  -15.375609     2  9628
9632  9631  O     16.718349  -16.746352  -16.413215     1  9632  9633
9633  9632  H     17.100500  -17.598643  -16.622479     2  9631
9634  9633  H     16.219589  -16.508547  -17.194828     2  9631
9635  9634  O      5.339452  -24.543441  -10.766410     1  9635  9636
9636  9635  H      5.617130  -25.327433  -10.292614     2  9634
9637  9636  H      5.747611  -23.819166  -10.292001     2  9634
9638  9637  O     -3.980438   19.445448   23.523217     1  9638  9639
9639  9638  H     -4.314515   20.291683   23.225710     2  9637
9640  9639  H     -4.610272   18.807436   23.187835     2  9637
9641  9640  O      1.578496  -16.033815   -7.477934     1  9641  9642
9642  9641  H      2.039655  -16.856839   -7.316084     2  9640
9643  9642  H      1.144464  -16.163717   -8.321126     2  9640
9644  9643  O     -4.278131  -20.396602  -22.320551     1  9644  9645
9645  9644  H     -3.836150  -20.294224  -21.477697     2  9643
9646  9645  H     -3.590601  -20.253587  -22.970998     2  9643
9647  9646  O     12.247035  -17.669074  -11.108173     1  9647  9648
9648  9647  H     12.071746  -16.959457  -10.490153     2  9646
9649  9648  H     11.779802  -18.422519  -10.747277     2  9646
9650  9649  O      8.073048  -21.403710  -19.742708     1  9650  9651
9651  9650  H      9.011344  -21.231719  -19.821777     2  9649
9652  9651  H      7.977297  -22.326067  -19.980026     2  9649
9653  9652  O      4.557376   -3.735113  -14.043365     1  9653  9654
9654  9653  H      3.979986   -4.327683  -14.524730     2  9652
9655  9654  H      5.179888   -4.312764  -13.601743     2  9652
9656  9655  O     13.137343   -3.093368  -29.303957     1  9656  9657
9657  9656  H     13.753224   -2.414370  -29.579427     2  9655
9658  9657  H     12.291677   -2.803399  -29.646007     2  9655
9659  9658  O      4.727491    1.002568  -23.361961     1  9659  9660
9660  9659  H      4.039666    0.519415  -23.819880     2  9658
9661  9660  H      4.819598    1.816410  -23.857350     2  9658
9662  9661  O     13.791460    2.940709  -16.180978     1  9662  9663
9663  9662  H     13.894567    2.155894  -16.719183     2  9661
9664  9663  H     14.685909    3.243325  -16.024082     2  9661
9665  9664  O      4.683849   -8.175383  -27.862297     1  9665  9666
9666  9665  H      5.306668   -8.806878  -28.222217     2  9664
9667  9666  H      3.828999   -8.591512  -27.973205     2  9664
9668  9667  O      6.031181  -29.243606  -11.560002     1  9668  9669
9669  9668  H      5.426379  -29.815788  -11.087715     2  9667
9670  9669  H      6.545659  -28.819206  -10.873395     2  9667
9671  9670  O      7.347194  -22.177937    3.974608     1  9671  9672
9672  9671  H      6.944751  -22.282935    3.112489     2  9670
9673  9672  H      8.276043  -22.357883    3.829386     2  9670
9674  9673  O      6.860330  -21.136874  -17.162940     1  9674  9675
9675  9674  H      6.500590  -22.004641  -16.979097     2  9673
9676  9675  H      7.476415  -21.279778  -17.881445     2  9673
9677  9676  O     17.092149  -24.879360   -0.880698     1  9677  9678
9678  9677  H     17.828901  -25.328894   -1.294638     2  9676
9679  9678  H     16.317647  -25.338452   -1.205678     2  9676
9680  9679  O    -14.196487    6.061654   26.432281     1  9680  9681
9681  9680  H    -14.410141    5.171049   26.154060     2  9679
9682  9681  H    -13.533826    6.355847   25.807330     2  9679
9683  9682  O     -3.413198   35.466069   13.571155     1  9683  9684
9684  9683  H     -3.629845   35.517049   12.640189     2  9682
9685  9684  H     -2.687256   34.843713   13.614889     2  9682
9686  9685  O      8.987039   -7.170630  -26.736727     1  9686  9687
9687  9686  H      9.486275   -6.762721  -26.029193     2  9685
9688  9687  H      9.599638   -7.786718  -27.138461     2  9685
9689  9688  O     -5.063969  -18.143609    1.152886     1  9689  9690
9690  9689  H     -5.721008  -17.604575    0.712463     2  9688
9691  9690  H     -5.440440  -19.023645    1.159023     2  9688
9692  9691  O      5.658391   34.357825   -7.446711     1  9692  9693
9693  9692  H      5.868080   35.265144   -7.225273     2  9691
9694  9693  H      5.068951   34.424217   -8.197965     2  9691
9695  9694  O      2.951082    1.971245   -0.390783     1  9695  9696
9696  9695  H      3.014507    1.759152    0.540467     2  9694
9697  9696  H      2.199112    2.560325   -0.452080     2  9694
9698  9697  O     14.830440  -21.710199   -9.249565     1  9698  9699
9699  9698  H     14.164191  -21.956721   -8.608027     2  9697
9700  9699  H     14.979844  -22.506919   -9.758630     2  9697
9701  9700  O      5.356755  -34.941126   -2.232072     1  9701  9702
9702  9701  H      4.410808  -34.913076   -2.088440     2  9700
9703  9702  H      5.497821  -34.398998   -3.008235     2  9700
9704  9703  O      2.261280  -13.828213  -26.957569     1  9704  9705
9705  9704  H      1.537656  -14.263443  -26.506820     2  9703
9706  9705  H      2.981600  -14.457361  -26.918299     2  9703
9707  9706  O      4.846247  -22.894436  -16.153424     1  9707  9708
9708  9707  H      4.722582  -23.184629  -15.249695     2  9706
9709  9708  H      4.355097  -23.526843  -16.677889     2  9706
9710  9709  O     19.567953  -31.995881   -0.567029     1  9710  9711
9711  9710  H     20.413209  -32.195021   -0.969667     2  9709
9712  9711  H     19.135891  -31.413309   -1.191661     2  9709
9713  9712  O      5.307501  -21.574599   -5.640883     1  9713  9714
9714  9713  H      4.619906  -21.619857   -6.305259     2  9712
9715  9714  H      5.508814  -20.641727   -5.567018     2  9712
9716  9715  O      8.096005   -3.960701   30.857644     1  9716  9717
9717  9716  H      7.857983   -3.097213   31.195233     2  9715
9718  9717  H      8.582256   -4.372057   31.572191     2  9715
9719  9718  O     -3.823221  -30.247713  -14.303960     1  9719  9720
9720  9719  H     -3.231730  -29.930334  -13.621581     2  9718
9721  9720  H     -3.777259  -29.581898  -14.990115     2  9718
9722  9721  O      2.982197   -5.198494   -6.783567     1  9722  9723
9723  9722  H      2.988518   -5.079083   -7.733268     2  9721
9724  9723  H      3.647344   -4.590514   -6.460812     2  9721
9725  9724  O     14.094522  -24.218386   -1.027472     1  9725  9726
9726  9725  H     13.867793  -25.015329   -0.548194     2  9724
9727  9726  H     13.789817  -23.505683   -0.465830     2  9724
9728  9727  O     13.793218  -18.079113   -8.241109     1  9728  9729
9729  9728  H     12.972650  -17.613798   -8.078684     2  9727
9730  9729  H     13.697003  -18.906861   -7.770144     2  9727
9731  9730  O     32.272771  -13.125997   -4.998709     1  9731  9732
9732  9731  H     32.841921  -13.697928   -5.513679     2  9730
9733  9732  H     31.943420  -12.484923   -5.628616     2  9730
9734  9733  O      2.038129  -11.133470  -34.071788     1  9734  9735
9735  9734  H      1.718016  -11.981804  -33.765051     2  9733
9736  9735  H      1.902415  -10.543410  -33.330410     2  9733
9737  9736  O      5.297405   -3.352209   -6.697330     1  9737  9738
9738  9737  H      6.112557   -3.065156   -6.285797     2  9736
9739  9738  H      5.074090   -2.647147   -7.304989     2  9736
9740  9739  O     10.864179   -6.350816  -19.428974     1  9740  9741
9741  9740  H     10.779931   -7.227067  -19.053051     2  9739
9742  9741  H     11.437923   -5.883375  -18.821892     2  9739
9743  9742  O     -3.183136   14.987985   26.769479     1  9743  9744
9744  9743  H     -2.865407   15.192747   27.648883     2  9742
9745  9744  H     -2.390175   14.814731   26.262105     2  9742
9746  9745  O      9.040210   34.772301   -7.637533     1  9746  9747
9747  9746  H      8.100120   34.719817   -7.465172     2  9745
9748  9747  H      9.415957   34.044233   -7.142594     2  9745
9749  9748  O    -15.070987    7.451696   22.901327     1  9749  9750
9750  9749  H    -15.196223    8.124932   23.570132     2  9748
9751  9750  H    -15.059051    6.628170   23.389071     2  9748
9752  9751  O      6.284057    1.196920  -20.073228     1  9752  9753
9753  9752  H      5.906129    1.073384  -19.202516     2  9751
9754  9753  H      6.357520    2.146330  -20.170466     2  9751
9755  9754  O     11.347193  -17.045759    0.791369     1  9755  9756
9756  9755  H     11.805970  -17.860019    0.998094     2  9754
9757  9756  H     12.027161  -16.372753    0.822000     2  9754
9758  9757  O     14.359766  -22.797118   -5.902539     1  9758  9759
9759  9758  H     14.364331  -23.412547   -5.169424     2  9757
9760  9759  H     14.478534  -23.346190   -6.677552     2  9757
9761  9760  O      2.046917   -4.853906  -26.929154     1  9761  9762
9762  9761  H      1.508800   -5.187251  -27.647166     2  9760
9763  9762  H      2.073091   -5.571166  -26.295841     2  9760
9764  9763  O     24.805306   -6.426451   -0.276554     1  9764  9765
9765  9764  H     24.506938   -5.609525   -0.676353     2  9763
9766  9765  H     24.023932   -6.788555    0.141259     2  9763
9767  9766  O      7.300908   -5.314151  -27.775659     1  9767  9768
9768  9767  H      7.937575   -6.015003  -27.635328     2  9766
9769  9768  H      6.529934   -5.587183  -27.278382     2  9766
9770  9769  O     23.731768  -22.041522   -5.733079     1  9770  9771
9771  9770  H     23.091029  -21.939442   -6.436829     2  9769
9772  9771  H     24.065836  -21.157231   -5.582551     2  9769
9773  9772  O     -0.709346   -0.112593   -2.117064     1  9773  9774
9774  9773  H     -0.441544    0.494676   -2.806801     2  9772
9775  9774  H      0.097960   -0.305333   -1.640261     2  9772
9776  9775  O     12.156834  -13.539680  -26.189157     1  9776  9777
9777  9776  H     12.487200  -12.641303  -26.186022     2  9775
9778  9777  H     11.205644  -13.445773  -26.137668     2  9775
9779  9778  O     26.176039   -0.549027  -26.757984     1  9779  9780
9780  9779  H     25.762775   -0.304121  -27.585913     2  9778
9781  9780  H     27.115278   -0.515806  -26.939523     2  9778
9782  9781  O     13.816339  -32.715725   -2.419652     1  9782  9783
9783  9782  H     14.667958  -32.789668   -2.850360     2  9781
9784  9783  H     13.256514  -32.286825   -3.066856     2  9781
9785  9784  O      3.116037   -4.993394   -9.582936     1  9785  9786
9786  9785  H      3.239482   -4.300150  -10.231322     2  9784
9787  9786  H      2.615703   -5.666772  -10.043869     2  9784
9788  9787  O     17.663971   -5.445557  -15.012056     1  9788  9789
9789  9788  H     17.044245   -5.659140  -14.314522     2  9787
9790  9789  H     17.798935   -4.501278  -14.932336     2  9787
9791  9790  O     18.324149    5.816883  -19.490242     1  9791  9792
9792  9791  H     18.490422    6.680554  -19.867942     2  9790
9793  9792  H     18.080398    5.270937  -20.237745     2  9790
9794  9793  O     15.468281   -5.753030  -25.853984     1  9794  9795
9795  9794  H     15.307300   -5.385082  -26.722852     2  9793
9796  9795  H     16.015169   -6.521640  -26.016415     2  9793
9797  9796  O      9.763278  -21.941663  -11.762745     1  9797  9798
9798  9797  H      9.256449  -22.167596  -10.982803     2  9796
9799  9798  H     10.489766  -22.564911  -11.765724     2  9796
9800  9799  O     10.642797  -17.669593   -2.756602     1  9800  9801
9801  9800  H     11.353572  -18.100340   -2.281747     2  9799
9802  9801  H      9.914600  -18.289283   -2.712506     2  9799
9803  9802  O      2.372340    7.598508  -17.330320     1  9803  9804
9804  9803  H      2.885249    7.841017  -16.559382     2  9802
9805  9804  H      1.916875    6.796872  -17.073100     2  9802
9806  9805  O     16.175681    1.592674   -2.000309     1  9806  9807
9807  9806  H     15.830765    0.721577   -1.804212     2  9805
9808  9807  H     15.873530    1.775756   -2.889925     2  9805
9809  9808  O    -22.176995   10.760960   14.601634     1  9809  9810
9810  9809  H    -21.759357   10.894363   15.452524     2  9808
9811  9810  H    -22.678223   11.562590   14.451998     2  9808
9812  9811  O    -13.907372   10.097689   24.643887     1  9812  9813
9813  9812  H    -14.780320   10.434216   24.441543     2  9811
9814  9813  H    -13.445275   10.843669   25.026263     2  9811
9815  9814  O      9.085412  -10.200123  -34.859123     1  9815  9816
9816  9815  H      9.192611  -10.945501  -34.268233     2  9814
9817  9816  H      8.742452  -10.581819  -35.667156     2  9814
9818  9817  O      8.324158    0.496697   -0.060102     1  9818  9819
9819  9818  H      7.866840    0.694847   -0.877309     2  9817
9820  9819  H      9.204102    0.852032   -0.185270     2  9817
9821  9820  O      3.096331  -34.932769    9.940204     1  9821  9822
9822  9821  H      3.050284  -35.291702    9.054044     2  9820
9823  9822  H      3.125878  -33.984416    9.813770     2  9820
9824  9823  O      8.474160  -22.715344   -9.509890     1  9824  9825
9825  9824  H      7.575445  -22.494715   -9.265216     2  9823
9826  9825  H      8.594537  -23.612217   -9.197865     2  9823
9827  9826  O     10.922526  -18.793328  -18.219171     1  9827  9828
9828  9827  H     11.448890  -18.337169  -17.562596     2  9826
9829  9828  H     10.228639  -18.173312  -18.443523     2  9826
9830  9829  O     17.227741  -20.375328   -2.637731     1  9830  9831
9831  9830  H     17.058926  -19.867232   -3.431186     2  9829
9832  9831  H     17.273175  -21.282756   -2.938964     2  9829
9833  9832  O     18.750332  -18.846055  -15.775262     1  9833  9834
9834  9833  H     19.357281  -18.871917  -15.035548     2  9832
9835  9834  H     19.083876  -19.506470  -16.382577     2  9832
9836  9835  O     25.568629   -3.817989  -11.042962     1  9836  9837
9837  9836  H     25.327165   -4.717341  -10.821395     2  9835
9838  9837  H     26.093506   -3.899662  -11.839244     2  9835
9839  9838  O     31.523466    0.887042  -19.905086     1  9839  9840
9840  9839  H     31.147396    1.482233  -20.553585     2  9838
9841  9840  H     32.438724    1.157866  -19.833063     2  9838
9842  9841  O      9.099239   -1.444190  -22.051881     1  9842  9843
9843  9842  H      8.155659   -1.593277  -22.112387     2  9841
9844  9843  H      9.480924   -2.321969  -22.044757     2  9841
9845  9844  O      9.868752   -6.308701  -21.887777     1  9845  9846
9846  9845  H      8.965976   -6.621829  -21.831414     2  9844
9847  9846  H     10.214007   -6.410843  -21.000873     2  9844
9848  9847  O     17.581608   -5.327998  -17.982553     1  9848  9849
9849  9848  H     16.749354   -5.792829  -17.895841     2  9847
9850  9849  H     17.631078   -4.776702  -17.201620     2  9847
9851  9850  O     -0.624367  -14.523005   -5.014039     1  9851  9852
9852  9851  H      0.312506  -14.479846   -5.205449     2  9850
9853  9852  H     -0.913635  -15.342819   -5.414615     2  9850
9854  9853  O     14.801428  -13.316416   -0.289340     1  9854  9855
9855  9854  H     13.895238  -13.301905   -0.597299     2  9853
9856  9855  H     15.300089  -13.667148   -1.027280     2  9853
9857  9856  O     18.118552   -8.207814  -15.102402     1  9857  9858
9858  9857  H     18.918195   -7.939698  -15.555079     2  9856
9859  9858  H     17.688361   -7.385534  -14.867834     2  9856
9860  9859  O      7.592184  -24.279391  -16.335089     1  9860  9861
9861  9860  H      8.482342  -24.230958  -16.683665     2  9859
9862  9861  H      7.634705  -23.809560  -15.502214     2  9859
9863  9862  O      8.823715   -5.239781  -30.310844     1  9863  9864
9864  9863  H      8.383539   -4.622011  -30.894657     2  9862
9865  9864  H      8.299108   -5.228866  -29.510282     2  9862
9866  9865  O     15.403867   -7.828784  -22.844582     1  9866  9867
9867  9866  H     15.073440   -8.613820  -22.407814     2  9865
9868  9867  H     16.347592   -7.844788  -22.685339     2  9865
9869  9868  O     34.088388   -4.414846  -14.070904     1  9869  9870
9870  9869  H     34.750650   -5.030835  -13.757540     2  9868
9871  9870  H     34.354727   -4.211735  -14.967588     2  9868
9872  9871  O     23.851988  -12.311152   -7.429635     1  9872  9873
9873  9872  H     23.077488  -12.733506   -7.058154     2  9871
9874  9873  H     23.597969  -11.394336   -7.535248     2  9871
9875  9874  O     16.193805    5.583462  -18.026003     1  9875  9876
9876  9875  H     16.955027    5.363728  -18.563117     2  9874
9877  9876  H     15.441263    5.343636  -18.566740     2  9874
9878  9877  O     21.944124   -7.985228  -20.072077     1  9878  9879
9879  9878  H     22.112059   -8.187109  -19.151602     2  9877
9880  9879  H     21.962603   -7.029185  -20.115329     2  9877
9881  9880  O      5.230153    0.097732   -3.734297     1  9881  9882
9882  9881  H      5.415346    0.487282   -2.879788     2  9880
9883  9882  H      6.092808   -0.067156   -4.114915     2  9880
9884  9883  O     16.398723  -13.379356   -9.469796     1  9884  9885
9885  9884  H     15.596232  -13.117924   -9.921340     2  9883
9886  9885  H     17.078461  -12.819498   -9.844960     2  9883
9887  9886  O      4.020327  -10.783547  -21.161005     1  9887  9888
9888  9887  H      3.134175  -10.567317  -21.451195     2  9886
9889  9888  H      4.326851  -11.435527  -21.791240     2  9886
9890  9889  O      6.416319   -5.503070  -12.789840     1  9890  9891
9891  9890  H      6.516049   -6.398682  -12.467094     2  9889
9892  9891  H      7.089345   -5.004615  -12.326364     2  9889
9893  9892  O    -26.187116   22.850393    4.457685     1  9893  9894
9894  9893  H    -25.606245   23.584320    4.658114     2  9892
9895  9894  H    -26.191510   22.801941    3.501722     2  9892
9896  9895  O     16.613360    4.482489  -21.255070     1  9896  9897
9897  9896  H     16.232551    5.360678  -21.256122     2  9895
9898  9897  H     15.953909    3.935463  -20.828316     2  9895
9899  9898  O     15.947208  -15.186171    3.817870     1  9899  9900
9900  9899  H     16.449774  -15.935968    3.499337     2  9898
9901  9900  H     15.202558  -15.124745    3.219577     2  9898
9902  9901  O      3.041957  -18.122805  -10.005874     1  9902  9903
9903  9902  H      2.086862  -18.074632   -9.964599     2  9901
9904  9903  H      3.327924  -17.996892   -9.101108     2  9901
9905  9904  O     19.189404  -11.435170  -22.529016     1  9905  9906
9906  9905  H     18.663949  -11.819979  -21.827553     2  9904
9907  9906  H     19.925416  -12.037772  -22.635738     2  9904
9908  9907  O      4.819650  -18.841425   -3.343589     1  9908  9909
9909  9908  H      3.875153  -18.708976   -3.424914     2  9907
9910  9909  H      5.061282  -18.365018   -2.549308     2  9907
9911  9910  O     29.025698   -4.579002  -10.986322     1  9911  9912
9912  9911  H     28.980935   -5.359638  -11.538441     2  9910
9913  9912  H     28.493295   -3.929441  -11.445504     2  9910
9914  9913  O     14.686103   -5.038263  -28.317778     1  9914  9915
9915  9914  H     15.353943   -5.169870  -28.990757     2  9913
9916  9915  H     13.971377   -4.592895  -28.772800     2  9913
9917  9916  O      2.065177   -2.572930  -11.175850     1  9917  9918
9918  9917  H      2.758750   -1.982579  -11.470255     2  9916
9919  9918  H      1.410158   -2.540197  -11.873066     2  9916
9920  9919  O     10.036553  -23.424559  -17.378938     1  9920  9921
9921  9920  H     10.146389  -23.068965  -18.260823     2  9919
9922  9921  H      9.757857  -22.676077  -16.851363     2  9919
9923  9922  O      0.915505   20.558133   24.554657     1  9923  9924
9924  9923  H      1.775741   20.778358   24.197269     2  9922
9925  9924  H      0.685956   21.306253   25.105888     2  9922
9926  9925  O     -5.814507   -7.948495  -33.473709     1  9926  9927
9927  9926  H     -5.754835   -8.902913  -33.515653     2  9925
9928  9927  H     -5.115651   -7.638796  -34.049832     2  9925
9929  9928  O      8.268782  -24.059524  -20.374567     1  9929  9930
9930  9929  H      9.145552  -24.340119  -20.636811     2  9928
9931  9930  H      7.832783  -24.864495  -20.094999     2  9928
9932  9931  O    -23.712153   -1.344163   23.359200     1  9932  9933
9933  9932  H    -23.786594   -2.066806   22.735920     2  9931
9934  9933  H    -23.467197   -0.589582   22.823628     2  9931
9935  9934  O     -1.535396   -1.275007  -21.379079     1  9935  9936
9936  9935  H     -0.996873   -0.695051  -21.917480     2  9934
9937  9936  H     -2.402430   -1.241203  -21.783234     2  9934
9938  9937  O     15.821274  -27.181611   -6.112128     1  9938  9939
9939  9938  H     15.813111  -28.075246   -6.455030     2  9937
9940  9939  H     16.739521  -27.014437   -5.899743     2  9937
9941  9940  O     14.840181  -15.163853  -15.207310     1  9941  9942
9942  9941  H     15.487110  -15.760374  -15.583977     2  9940
9943  9942  H     14.847953  -15.361677  -14.270807     2  9940
9944  9943  O     11.206572  -20.000895  -13.998706     1  9944  9945
9945  9944  H     11.730303  -19.575307  -13.319873     2  9943
9946  9945  H     11.723918  -20.763261  -14.258287     2  9943
9947  9946  O      5.089460   -9.048789  -16.855318     1  9947  9948
9948  9947  H      4.813229   -8.796025  -17.736249     2  9946
9949  9948  H      5.430957   -8.241813  -16.470090     2  9946
9950  9949  O    -18.605371   14.207856   20.636306     1  9950  9951
9951  9950  H    -17.688711   14.157726   20.365286     2  9949
9952  9951  H    -19.090052   13.796551   19.920663     2  9949
9953  9952  O      9.838617  -10.199975  -25.040279     1  9953  9954
9954  9953  H      9.826875  -10.583233  -24.163235     2  9952
9955  9954  H     10.093874   -9.288118  -24.900312     2  9952
9956  9955  O      9.406317  -14.830289   -6.440569     1  9956  9957
9957  9956  H      9.262027  -14.282196   -5.669203     2  9955
9958  9957  H      9.273612  -14.240209   -7.182476     2  9955
9959  9958  O      4.100294  -15.799689  -26.969260     1  9959  9960
9960  9959  H      4.299679  -16.557250  -26.419189     2  9958
9961  9960  H      4.011586  -16.160374  -27.851456     2  9958
9962  9961  O      8.408696   -8.028449  -14.261745     1  9962  9963
9963  9962  H      8.833209   -7.220211  -14.549444     2  9961
9964  9963  H      8.917775   -8.309399  -13.501392     2  9961
9965  9964  O      1.326502   -4.513671  -23.064953     1  9965  9966
9966  9965  H      0.391388   -4.618102  -22.889204     2  9964
9967  9966  H      1.582264   -5.329259  -23.495804     2  9964
9968  9967  O      8.568304  -18.443497   -5.983385     1  9968  9969
9969  9968  H      7.647591  -18.497354   -5.727226     2  9967
9970  9969  H      8.577949  -18.712320   -6.902010     2  9967
9971  9970  O     14.256157  -19.835285  -14.065182     1  9971  9972
9972  9971  H     14.558774  -20.214741  -14.890209     2  9970
9973  9972  H     13.565188  -20.427258  -13.767925     2  9970
9974  9973  O      4.738405  -16.292167    1.442152     1  9974  9975
9975  9974  H      5.403232  -16.212255    2.126148     2  9973
9976  9975  H      4.212608  -15.496553    1.524416     2  9973
9977  9976  O     -4.647246   -1.668544  -34.148627     1  9977  9978
9978  9977  H     -4.737257   -1.079546  -33.399487     2  9976
9979  9978  H     -4.002280   -1.242207  -34.712973     2  9976
9980  9979  O     24.826037   -6.596349   -3.416993     1  9980  9981
9981  9980  H     24.579494   -5.740947   -3.768755     2  9979
9982  9981  H     25.349610   -6.998911   -4.109848     2  9979
9983  9982  O      6.033601   -4.987326   -9.125624     1  9983  9984
9984  9983  H      6.363611   -5.586566   -9.795128     2  9982
9985  9984  H      5.126366   -4.819087   -9.380285     2  9982
9986  9985  O    -27.909915    3.772178   20.916021     1  9986  9987
9987  9986  H    -27.344084    3.213396   21.448777     2  9985
9988  9987  H    -27.781326    3.459645   20.020465     2  9985
9989  9988  O      3.820077  -35.534520   -8.404859     1  9989  9990
9990  9989  H      3.935460  -35.910102   -9.277702     2  9988
9991  9990  H      3.187603  -34.826979   -8.529739     2  9988
9992  9991  O     -0.480297   -1.380840  -30.463207     1  9992  9993
9993  9992  H     -0.936088   -0.649664  -30.880182     2  9991
9994  9993  H     -1.166549   -1.855082  -29.993757     2  9991
9995  9994  O      2.631171  -29.183558  -14.690357     1  9995  9996
9996  9995  H      3.114610  -29.924167  -14.324276     2  9994
9997  9996  H      2.286449  -28.720882  -13.926597     2  9994
9998  9997  O      0.721210    1.951422  -10.663676     1  9998  9999
9999  9998  H      0.864003    1.302525   -9.974638     2  9997
10000  9999  H     -0.215445    2.144113  -10.621490     2  9997
10001 10000  O      2.600468  -21.427615  -10.509144     1 10001 10002
10002 10001  H      2.405250  -21.744825  -11.390904     2 10000
10003 10002  H      2.803727  -20.499753  -10.627421     2 10000
10004 10003  O     30.509060   15.805021    2.874700     1 10004 10005
10005 10004  H     29.686061   15.588457    2.436518     2 10003
10006 10005  H     30.496873   15.285542    3.678581     2 10003
10007 10006  O     10.299192   -5.075100  -24.821692     1 10007 10008
10008 10007  H     10.592302   -5.866914  -24.370749     2 10006
10009 10008  H     11.007959   -4.869857  -25.431411     2 10006
10010 10009  O     13.638484  -20.259718   -6.581053     1 10010 10011
10011 10010  H     12.716049  -20.515333   -6.583502     2 10009
10012 10011  H     14.114726  -21.080826   -6.457742     2 10009
10013 10012  O     21.740986  -15.637018  -15.460077     1 10013 10014
10014 10013  H     21.865201  -15.149014  -14.646041     2 10012
10015 10014  H     22.432784  -15.317529  -16.039363     2 10012
10016 10015  O      6.795247  -32.277635   -9.077804     1 10016 10017
10017 10016  H      7.525513  -32.165968   -9.686470     2 10015
10018 10017  H      6.094371  -31.736999   -9.442108     2 10015
10019 10018  O    -21.891706   26.701706   -3.669140     1 10019 10020
10020 10019  H    -22.381870   27.418526   -3.266472     2 10018
10021 10020  H    -22.558121   26.170075   -4.104446     2 10018
10022 10021  O      6.836605  -35.751620   -8.058329     1 10022 10023
10023 10022  H      6.300383  -35.114657   -7.586126     2 10021
10024 10023  H      7.736287  -35.538621   -7.810468     2 10021
10025 10024  O     18.874969  -14.705129  -11.727409     1 10025 10026
10026 10025  H     18.274640  -15.327951  -11.317617     2 10024
10027 10026  H     18.946695  -15.002260  -12.634492     2 10024
10028 10027  O     19.241380  -18.003089  -13.114226     1 10028 10029
10029 10028  H     19.311620  -17.108679  -13.447886     2 10027
10030 10029  H     18.598320  -17.945791  -12.407529     2 10027
10031 10030  O     -0.562060   -2.435098    1.425617     1 10031 10032
10032 10031  H     -0.011476   -1.770747    1.011219     2 10030
10033 10032  H     -0.910368   -2.947380    0.695904     2 10030
10034 10033  O     -3.331184  -17.502674   -7.511987     1 10034 10035
10035 10034  H     -2.863444  -17.149998   -6.754973     2 10033
10036 10035  H     -3.724326  -16.736313   -7.929555     2 10033
10037 10036  O      2.237790  -29.038508   -2.150162     1 10037 10038
10038 10037  H      1.787867  -28.261456   -2.481811     2 10036
10039 10038  H      2.831439  -28.703575   -1.478126     2 10036
10040 10039  O    -15.649067    9.412426   27.727462     1 10040 10041
10041 10040  H    -15.162794   10.146540   28.102758     2 10039
10042 10041  H    -15.038041    8.676491   27.763218     2 10039
10043 10042  O     19.114750  -15.246721    0.153872     1 10043 10044
10044 10043  H     19.249084  -16.028420    0.689720     2 10042
10045 10044  H     18.432049  -14.756308    0.611744     2 10042
10046 10045  O     13.409908   -8.736122    3.008697     1 10046 10047
10047 10046  H     13.954183   -9.422273    3.394951     2 10045
10048 10047  H     12.680354   -9.206873    2.605737     2 10045
10049 10048  O      1.588433   -0.475275  -14.928243     1 10049 10050
10050 10049  H      1.662605    0.118097  -15.675665     2 10048
10051 10050  H      1.553589   -1.348878  -15.317903     2 10048
10052 10051  O     13.261566   -4.535024  -11.190542     1 10052 10053
10053 10052  H     12.319499   -4.614294  -11.040684     2 10051
10054 10053  H     13.343683   -3.832705  -11.835706     2 10051
10055 10054  O      5.582094  -34.501366  -14.443964     1 10055 10056
10056 10055  H      4.799793  -34.478338  -13.892867     2 10054
10057 10056  H      6.053105  -33.697141  -14.225786     2 10054
10058 10057  O      1.818969   -9.346428  -11.070153     1 10058 10059
10059 10058  H      1.850407   -8.436269  -11.364863     2 10057
10060 10059  H      2.652865   -9.719961  -11.355325     2 10057
10061 10060  O     16.297385  -15.076680   -2.079537     1 10061 10062
10062 10061  H     16.966583  -15.725911   -2.296111     2 10060
10063 10062  H     15.786807  -14.980938   -2.883513     2 10060
10064 10063  O      4.504931    1.461321  -14.569025     1 10064 10065
10065 10064  H      5.061255    2.149824  -14.204746     2 10063
10066 10065  H      3.626249    1.669773  -14.251696     2 10063
10067 10066  O     -5.247685   -5.427420  -31.115822     1 10067 10068
10068 10067  H     -4.369137   -5.414578  -31.495584     2 10066
10069 10068  H     -5.801525   -5.014232  -31.778219     2 10066
10070 10069  O     13.833078  -21.962498    1.031380     1 10070 10071
10071 10070  H     14.639143  -21.495525    0.811319     2 10069
10072 10071  H     14.108863  -22.639017    1.649843     2 10069
10073 10072  O      6.827392   -7.301253  -24.609695     1 10073 10074
10074 10073  H      7.318967   -7.518494  -23.817614     2 10072
10075 10074  H      7.484388   -6.951335  -25.211479     2 10072
10076 10075  O     10.704064  -20.321778   -6.203491     1 10076 10077
10077 10076  H     10.329601  -19.440951   -6.191092     2 10075
10078 10077  H     10.176125  -20.815844   -5.576266     2 10075
10079 10078  O     13.012907   -8.549988  -27.448615     1 10079 10080
10080 10079  H     13.907100   -8.880777  -27.363599     2 10078
10081 10080  H     13.025643   -8.027157  -28.250311     2 10078
10082 10081  O      4.651175   -5.378220  -18.088717     1 10082 10083
10083 10082  H      5.506731   -5.615305  -18.446553     2 10081
10084 10083  H      4.628428   -5.792983  -17.226345     2 10081
10085 10084  O      2.621270  -13.404023  -12.315855     1 10085 10086
10086 10085  H      2.655814  -14.168225  -11.740500     2 10084
10087 10086  H      1.710030  -13.113847  -12.274985     2 10084
10088 10087  O     -5.065359  -15.046596  -26.597462     1 10088 10089
10089 10088  H     -4.167540  -15.378199  -26.583661     2 10087
10090 10089  H     -4.989821  -14.137291  -26.308171     2 10087
10091 10090  O     17.641105   -9.660284  -23.807772     1 10091 10092
10092 10091  H     18.309592  -10.329394  -23.660638     2 10090
10093 10092  H     17.728655   -9.065681  -23.062779     2 10090
10094 10093  O      7.616635  -26.603370  -19.261263     1 10094 10095
10095 10094  H      6.981670  -26.966310  -18.643748     2 10093
10096 10095  H      8.390335  -27.158486  -19.163967     2 10093
10097 10096  O     24.521083   -6.302000   -9.982490     1 10097 10098
10098 10097  H     23.610383   -6.011328  -10.031148     2 10096
10099 10098  H     24.497933   -7.213558  -10.273622     2 10096
10100 10099  O     -1.333534   -5.713928  -11.589727     1 10100 10101
10101 10100  H     -1.459328   -6.051490  -10.702902     2 10099
10102 10101  H     -1.624686   -4.803259  -11.543420     2 10099
10103 10102  O    -13.159249   21.271165   18.657255     1 10103 10104
10104 10103  H    -13.854188   20.958159   18.078188     2 10102
10105 10104  H    -12.509408   21.653391   18.067473     2 10102
10106 10105  O     22.322927  -18.386195  -11.199129     1 10106 10107
10107 10106  H     23.002753  -17.899225  -10.733373     2 10105
10108 10107  H     21.846864  -17.719630  -11.694394     2 10105
10109 10108  O     14.299545  -24.592430   -3.741680     1 10109 10110
10110 10109  H     13.996984  -24.243727   -2.903173     2 10108
10111 10110  H     14.781236  -25.386906   -3.511436     2 10108
10112 10111  O     11.376424   -7.161968   -6.461745     1 10112 10113
10113 10112  H     11.314483   -7.035908   -5.514906     2 10111
10114 10113  H     11.965894   -6.468488   -6.758124     2 10111
10115 10114  O      6.531893    4.722115  -17.672598     1 10115 10116
10116 10115  H      6.950779    3.925645  -17.346405     2 10114
10117 10116  H      7.245217    5.356366  -17.744199     2 10114
10118 10117  O      0.558069   -9.296723  -26.051984     1 10118 10119
10119 10118  H     -0.210173   -9.847399  -25.901016     2 10117
10120 10119  H      1.303209   -9.868535  -25.867515     2 10117
10121 10120  O      6.338332   -2.974600  -20.324954     1 10121 10122
10122 10121  H      6.422471   -2.155518  -20.813069     2 10120
10123 10122  H      5.417457   -3.005934  -20.065649     2 10120
10124 10123  O     13.312103   -7.536490    0.037906     1 10124 10125
10125 10124  H     12.904927   -8.048440   -0.660912     2 10123
10126 10125  H     13.926896   -6.959026   -0.414639     2 10123
10127 10126  O      5.338202  -20.082623  -11.710949     1 10127 10128
10128 10127  H      4.924858  -19.638740  -12.451454     2 10126
10129 10128  H      6.258061  -19.822094  -11.758024     2 10126
10130 10129  O     -3.206970   17.139899   32.307129     1 10130 10131
10131 10130  H     -3.192924   17.388938   31.383000     2 10129
10132 10131  H     -4.003556   17.543101   32.652253     2 10129
10133 10132  O     11.500927    1.330532   -8.443657     1 10133 10134
10134 10133  H     11.397334    0.800641   -7.653267     2 10132
10135 10134  H     11.396249    0.709421   -9.164417     2 10132
10136 10135  O     14.059421   -7.887510   -5.536502     1 10136 10137
10137 10136  H     13.181618   -8.076444   -5.868160     2 10135
10138 10137  H     13.936580   -7.749652   -4.597281     2 10135
10139 10138  O      5.014134  -16.708205  -11.378085     1 10139 10140
10140 10139  H      4.634694  -17.463846  -11.826709     2 10138
10141 10140  H      4.399496  -16.516010  -10.669910     2 10138
10142 10141  O      6.893388  -23.113945  -22.475438     1 10142 10143
10143 10142  H      7.448602  -23.460204  -21.776815     2 10141
10144 10143  H      6.039863  -22.984717  -22.061883     2 10141
10145 10144  O      3.153103   -5.282238   -2.721202     1 10145 10146
10146 10145  H      3.825234   -5.464067   -2.064383     2 10144
10147 10146  H      2.734798   -4.475818   -2.419640     2 10144
10148 10147  O    -13.860407   27.352755    5.136052     1 10148 10149
10149 10148  H    -13.385952   27.778433    4.421964     2 10147
10150 10149  H    -14.782998   27.438357    4.895783     2 10147
10151 10150  O      8.323135  -27.673651   -1.362562     1 10151 10152
10152 10151  H      8.770529  -26.861476   -1.600137     2 10150
10153 10152  H      8.625279  -28.311943   -2.008721     2 10150
10154 10153  O      5.075787  -28.436593  -15.677778     1 10154 10155
10155 10154  H      5.456543  -27.785181  -15.088780     2 10153
10156 10155  H      4.196737  -28.589002  -15.330970     2 10153
10157 10156  O      5.969805  -31.900401   -2.554979     1 10157 10158
10158 10157  H      6.162442  -31.269779   -1.861122     2 10156
10159 10158  H      5.026029  -31.822762   -2.694591     2 10156
10160 10159  O     19.418091    3.585029  -12.918998     1 10160 10161
10161 10160  H     19.091603    2.686077  -12.958016     2 10159
10162 10161  H     19.728175    3.766458  -13.806219     2 10159
10163 10162  O     -8.444360   15.992799   14.663204     1 10163 10164
10164 10163  H     -7.517932   16.217260   14.750262     2 10162
10165 10164  H     -8.720125   16.421749   13.853150     2 10162
10166 10165  O      6.607537   -9.729892  -21.974670     1 10166 10167
10167 10166  H      5.830571  -10.158292  -21.615463     2 10165
10168 10167  H      6.926303  -10.334041  -22.645211     2 10165
10169 10168  O    -10.938481   21.944419   17.105760     1 10169 10170
10170 10169  H    -10.080318   21.520492   17.114397     2 10168
10171 10170  H    -10.775784   22.807912   16.726103     2 10168
10172 10171  O     27.060834  -16.521274   -6.410928     1 10172 10173
10173 10172  H     26.292848  -16.135847   -6.832680     2 10171
10174 10173  H     27.721225  -15.828823   -6.435981     2 10171
10175 10174  O     10.838979  -29.334614  -11.673748     1 10175 10176
10176 10175  H     10.312601  -29.644094  -12.410891     2 10174
10177 10176  H     11.435123  -30.058991  -11.483691     2 10174
10178 10177  O     -2.743406   -3.015999  -12.018280     1 10178 10179
10179 10178  H     -2.761795   -3.296606  -12.933240     2 10177
10180 10179  H     -3.413216   -2.334454  -11.962772     2 10177
10181 10180  O     -0.394196   34.902079   -9.896300     1 10181 10182
10182 10181  H     -0.679725   34.021644   -9.652294     2 10180
10183 10182  H     -0.572735   35.435528   -9.121841     2 10180
10184 10183  O    -14.176167   17.806416   20.284426     1 10184 10185
10185 10184  H    -14.582879   17.746315   19.420016     2 10183
10186 10185  H    -14.135510   18.745404   20.465759     2 10183
10187 10186  O    -22.382587   12.141474   19.819121     1 10187 10188
10188 10187  H    -22.055474   11.418893   20.354944     2 10186
10189 10188  H    -21.593991   12.589637   19.513346     2 10186
10190 10189  O      6.776991  -15.866260  -29.198428     1 10190 10191
10191 10190  H      6.279704  -16.635539  -28.920673     2 10189
10192 10191  H      7.672049  -16.186594  -29.310185     2 10189
10193 10192  O     17.798483  -23.371175   -9.406202     1 10193 10194
10194 10193  H     16.884131  -23.611038   -9.556728     2 10192
10195 10194  H     17.966437  -22.663331  -10.028280     2 10192
10196 10195  O      4.218592    4.171908  -16.088121     1 10196 10197
10197 10196  H      4.976387    4.358414  -16.642371     2 10195
10198 10197  H      3.539971    3.883598  -16.698517     2 10195
10199 10198  O    -18.207436   30.097952    0.228102     1 10199 10200
10200 10199  H    -17.533291   29.815008    0.845922     2 10198
10201 10200  H    -17.828577   30.861504   -0.207428     2 10198
10202 10201  O    -33.005263   -9.432179   -5.572144     1 10202 10203
10203 10202  H    -32.857537  -10.316223   -5.908112     2 10201
10204 10203  H    -32.733242   -8.855548   -6.286099     2 10201
10205 10204  O      3.863946   -5.412602  -23.989685     1 10205 10206
10206 10205  H      3.425974   -4.687928  -23.543300     2 10204
10207 10206  H      4.611426   -5.622666  -23.429882     2 10204
10208 10207  O     18.850366  -26.681060   -3.037287     1 10208 10209
10209 10208  H     19.442958  -26.373331   -2.351452     2 10207
10210 10209  H     19.260126  -26.396194   -3.854098     2 10207
10211 10210  O     17.844866    0.837238  -16.697561     1 10211 10212
10212 10211  H     18.136692    1.747593  -16.745769     2 10210
10213 10212  H     18.185883    0.519865  -15.861370     2 10210
10214 10213  O      5.140377  -22.843639   -3.290830     1 10214 10215
10215 10214  H      5.236134  -22.372245   -4.118386     2 10213
10216 10215  H      4.471460  -22.354324   -2.811923     2 10213
10217 10216  O      7.760247   -9.332593  -17.968985     1 10217 10218
10218 10217  H      8.538219   -9.629136  -17.496700     2 10216
10219 10218  H      7.096929   -9.996129  -17.779353     2 10216
10220 10219  O    -33.813927   16.965099   -1.956775     1 10220 10221
10221 10220  H    -33.274745   16.471005   -2.574340     2 10219
10222 10221  H    -33.266315   17.707131   -1.700374     2 10219
10223 10222  O      0.140833  -20.177529  -27.835368     1 10223 10224
10224 10223  H     -0.767944  -20.017202  -27.581101     2 10222
10225 10224  H      0.302989  -19.560070  -28.548588     2 10222
10226 10225  O     21.011798   -1.365566   -9.591710     1 10226 10227
10227 10226  H     21.912543   -1.515652   -9.304719     2 10225
10228 10227  H     20.972642   -1.747033  -10.468739     2 10225
10229 10228  O      0.418473  -19.180079    2.946929     1 10229 10230
10230 10229  H      0.608786  -18.297265    3.264188     2 10228
10231 10230  H      1.120096  -19.721514    3.308597     2 10228
10232 10231  O     13.031679    0.423285  -22.448255     1 10232 10233
10233 10232  H     13.920791    0.098947  -22.591487     2 10231
10234 10233  H     12.873197    0.284736  -21.514490     2 10231
10235 10234  O    -15.982147   11.557320   24.036237     1 10235 10236
10236 10235  H    -15.735371   12.441271   24.308202     2 10234
10237 10236  H    -16.734596   11.338397   24.585896     2 10234
10238 10237  O      9.965999  -33.994480   -0.239448     1 10238 10239
10239 10238  H      9.904213  -33.878173    0.708649     2 10237
10240 10239  H     10.800114  -33.589483   -0.477064     2 10237
10241 10240  O      8.358815  -19.107041   -2.348915     1 10241 10242
10242 10241  H      7.429536  -18.956542   -2.175646     2 10240
10243 10242  H      8.497838  -20.028198   -2.128977     2 10240
10244 10243  O     11.646537  -16.413977  -21.235101     1 10244 10245
10245 10244  H     12.546457  -16.417019  -20.908964     2 10243
10246 10245  H     11.216504  -15.712277  -20.746306     2 10243
10247 10246  O     23.181178  -10.512356   -4.694569     1 10247 10248
10248 10247  H     22.458688  -10.774247   -4.123908     2 10246
10249 10248  H     22.815477   -9.816557   -5.240790     2 10246
10250 10249  O    -15.847283   30.193921    4.428538     1 10250 10251
10251 10250  H    -16.095629   30.995837    3.968662     2 10249
10252 10251  H    -14.915832   30.305131    4.618969     2 10249
10253 10252  O    -18.829727   10.615606   20.073087     1 10253 10254
10254 10253  H    -19.465607   10.746778   20.776424     2 10252
10255 10254  H    -18.289398   11.405584   20.087655     2 10252
10256 10255  O     10.495155   36.006889   -4.622534     1 10256 10257
10257 10256  H     10.655626   36.938042   -4.469449     2 10255
10258 10257  H      9.630979   35.976606   -5.033041     2 10255
10259 10258  O    -32.435622   16.335046    1.014940     1 10259 10260
10260 10259  H    -32.380770   16.583564    0.092194     2 10258
10261 10260  H    -33.063630   16.950946    1.392435     2 10258
10262 10261  O     26.638750  -11.301829   -9.624697     1 10262 10263
10263 10262  H     26.538222  -12.079116  -10.174197     2 10261
10264 10263  H     27.488302  -10.938971   -9.875350     2 10261
10265 10264  O     -1.150276    2.172277  -17.464833     1 10265 10266
10266 10265  H     -1.300137    2.812802  -18.160175     2 10264
10267 10266  H     -1.004694    1.346511  -17.926511     2 10264
10268 10267  O      8.375106  -12.566518  -11.087672     1 10268 10269
10269 10268  H      8.241433  -11.744191  -10.616353     2 10267
10270 10269  H      7.505182  -12.963728  -11.128758     2 10267
10271 10270  O      6.688690  -13.984197   -6.717756     1 10271 10272
10272 10271  H      5.960098  -13.403397   -6.498535     2 10270
10273 10272  H      7.446234  -13.403212   -6.787145     2 10270
10274 10273  O    -14.407323   10.005569  -28.792455     1 10274 10275
10275 10274  H    -14.405997    9.948061  -29.747925     2 10273
10276 10275  H    -14.792724   10.861262  -28.604072     2 10273
10277 10276  O    -26.976536    1.956790   19.098359     1 10277 10278
10278 10277  H    -26.526616    1.882343   18.256777     2 10276
10279 10278  H    -27.752747    1.404476   19.005203     2 10276
10280 10279  O      2.329199  -15.410986   -4.063639     1 10280 10281
10281 10280  H      1.918746  -14.765777   -3.487910     2 10279
10282 10281  H      3.250041  -15.151771   -4.096645     2 10279
10283 10282  O     31.263003   -3.518900   -6.028902     1 10283 10284
10284 10283  H     30.627775   -2.889071   -6.369537     2 10282
10285 10284  H     31.395019   -4.138545   -6.746428     2 10282
10286 10285  O     13.820230  -17.078321  -19.817894     1 10286 10287
10287 10286  H     14.278202  -16.289407  -19.527881     2 10285
10288 10287  H     13.941187  -17.702696  -19.102522     2 10285
10289 10288  O     -4.646015    0.038169  -27.965897     1 10289 10290
10290 10289  H     -5.431801   -0.503171  -27.890253     2 10288
10291 10290  H     -4.062908   -0.288125  -27.280515     2 10288
10292 10291  O     10.517861  -25.948144   -2.049547     1 10292 10293
10293 10292  H     10.926021  -25.082686   -2.074439     2 10291
10294 10293  H     10.937314  -26.431855   -2.761105     2 10291
10295 10294  O     10.557138  -21.246017  -19.293267     1 10295 10296
10296 10295  H     10.735210  -20.351131  -19.003956     2 10294
10297 10296  H     11.419059  -21.607407  -19.499957     2 10294
10298 10297  O     10.656621  -24.020502   -7.472648     1 10298 10299
10299 10298  H     10.771496  -24.107244   -6.526333     2 10297
10300 10299  H      9.937875  -24.616718   -7.682798     2 10297
10301 10300  O    -26.390455    7.621694    8.848819     1 10301 10302
10302 10301  H    -27.246478    7.773580    8.448336     2 10300
10303 10302  H    -26.022437    8.497265    8.967851     2 10300
10304 10303  O     -2.603103  -23.886581  -26.453481     1 10304 10305
10305 10304  H     -2.566495  -23.343739  -25.665945     2 10303
10306 10305  H     -2.708539  -24.779399  -26.124858     2 10303
10307 10306  O     16.220851  -33.474071   -3.556455     1 10307 10308
10308 10307  H     16.466804  -32.617390   -3.905506     2 10306
10309 10308  H     17.051278  -33.877967   -3.304482     2 10306
10310 10309  O     15.519992  -24.729904   -7.329811     1 10310 10311
10311 10310  H     15.930748  -25.104332   -8.109115     2 10309
10312 10311  H     15.801738  -25.298625   -6.613287     2 10309
10313 10312  O    -10.385724  -32.113112   10.469841     1 10313 10314
10314 10313  H    -10.165508  -31.457268   11.131359     2 10312
10315 10314  H     -9.545446  -32.349058   10.076784     2 10312
10316 10315  O      6.807117    0.515626  -25.789954     1 10316 10317
10317 10316  H      7.001411    0.407916  -24.858890     2 10315
10318 10317  H      5.987715    0.038478  -25.920884     2 10315
10319 10318  O     26.604027   -7.279727   -7.635661     1 10319 10320
10320 10319  H     25.866679   -7.231833   -8.244148     2 10318
10321 10320  H     27.240081   -6.652491   -7.979524     2 10318
10322 10321  O     11.263997   -5.038356  -31.644296     1 10322 10323
10323 10322  H     10.908596   -4.446395  -32.307247     2 10321
10324 10323  H     10.538584   -5.181037  -31.036308     2 10321
10325 10324  O     18.387319  -17.019334   -1.748226     1 10325 10326
10326 10325  H     18.909912  -16.423395   -1.211583     2 10324
10327 10326  H     17.920313  -17.565041   -1.115501     2 10324
10328 10327  O     13.153480  -18.891353  -22.437237     1 10328 10329
10329 10328  H     13.064007  -17.953716  -22.266756     2 10327
10330 10329  H     13.019685  -18.977498  -23.381117     2 10327
10331 10330  O     16.507375   -6.653012  -12.376152     1 10331 10332
10332 10331  H     16.784495   -7.444648  -11.914906     2 10330
10333 10332  H     16.396465   -5.999379  -11.685721     2 10330
10334 10333  O    -19.064213   32.279208    2.905947     1 10334 10335
10335 10334  H    -19.030997   31.329117    2.794342     2 10333
10336 10335  H    -19.868935   32.434778    3.400368     2 10333
10337 10336  O     -0.817757   -6.236229  -34.145338     1 10337 10338
10338 10337  H     -1.127067   -6.319653  -35.047335     2 10336
10339 10338  H     -0.673297   -7.137417  -33.856852     2 10336
10340 10339  O      4.348644  -31.046847   -9.879961     1 10340 10341
10341 10340  H      3.853554  -30.227905   -9.858677     2 10339
10342 10341  H      3.793553  -31.650087  -10.374133     2 10339
10343 10342  O      8.254366  -25.696497    1.056556     1 10343 10344
10344 10343  H      8.063512  -26.079662    0.200407     2 10342
10345 10344  H      9.132590  -26.011669    1.270147     2 10342
10346 10345  O     -1.619779  -12.509672  -14.945866     1 10346 10347
10347 10346  H     -1.741200  -11.581977  -14.743701     2 10345
10348 10347  H     -0.819775  -12.538219  -15.470662     2 10345
10349 10348  O     13.656099   -3.438597  -13.644993     1 10349 10350
10350 10349  H     13.088668   -3.375792  -14.413309     2 10348
10351 10350  H     14.105621   -4.277550  -13.746577     2 10348
10352 10351  O      8.087371  -15.457898  -25.173391     1 10352 10353
10353 10352  H      7.914795  -15.249710  -24.255182     2 10351
10354 10353  H      8.275566  -14.612027  -25.579984     2 10351
10355 10354  O     16.480789   -5.299344  -22.725909     1 10355 10356
10356 10355  H     16.040768   -6.103440  -23.001668     2 10354
10357 10356  H     16.030993   -5.043707  -21.920573     2 10354
10358 10357  O     15.720737  -14.732767  -19.123525     1 10358 10359
10359 10358  H     15.697888  -13.975888  -18.537996     2 10357
10360 10359  H     16.652194  -14.884051  -19.283943     2 10357
10361 10360  O    -13.632551    7.596037   28.459277     1 10361 10362
10362 10361  H    -13.872608    7.131459   27.657547     2 10360
10363 10362  H    -14.258690    7.285431   29.113269     2 10360
10364 10363  O    -22.759420   13.392724   13.821249     1 10364 10365
10365 10364  H    -22.892493   13.129217   12.910706     2 10363
10366 10365  H    -23.378616   14.110047   13.956436     2 10363
10367 10366  O     16.113907  -26.562166   -2.890987     1 10367 10368
10368 10367  H     17.003212  -26.561684   -3.245061     2 10366
10369 10368  H     15.824764  -27.471252   -2.969665     2 10366
10370 10369  O    -29.714522   12.294274    6.864267     1 10370 10371
10371 10370  H    -29.269806   13.138427    6.940851     2 10369
10372 10371  H    -29.423972   11.799568    7.630478     2 10369
10373 10372  O      9.316250  -25.009844  -11.913486     1 10373 10374
10374 10373  H      9.254056  -24.375680  -12.627768     2 10372
10375 10374  H      8.914136  -25.805099  -12.262924     2 10372
10376 10375  O     10.656429   -3.795047  -21.942513     1 10376 10377
10377 10376  H     10.337805   -4.694938  -22.012566     2 10375
10378 10377  H     11.173064   -3.660848  -22.737063     2 10375
10379 10378  O    -12.555078   21.855063   14.774123     1 10379 10380
10380 10379  H    -12.991780   21.131994   14.323908     2 10378
10381 10380  H    -12.018310   21.431494   15.443975     2 10378
10382 10381  O    -14.726415    6.309479  -28.842964     1 10382 10383
10383 10382  H    -14.107639    6.914690  -28.434225     2 10381
10384 10383  H    -14.252661    5.953089  -29.594479     2 10381
10385 10384  O     -2.233028  -15.731189  -25.471367     1 10385 10386
10386 10385  H     -1.331128  -15.423824  -25.562663     2 10384
10387 10386  H     -2.318370  -15.952709  -24.544072     2 10384
10388 10387  O      8.453234   -8.536341   -7.391889     1 10388 10389
10389 10388  H      8.919381   -8.833481   -6.610450     2 10387
10390 10389  H      7.807224   -7.911339   -7.062838     2 10387
10391 10390  O     18.163094  -12.117373  -11.290197     1 10391 10392
10392 10391  H     18.577888  -12.971736  -11.409541     2 10390
10393 10392  H     18.659724  -11.706212  -10.582711     2 10390
10394 10393  O     31.313111   -2.444210  -11.059040     1 10394 10395
10395 10394  H     31.200158   -2.157035  -11.965133     2 10393
10396 10395  H     31.090526   -3.375069  -11.072793     2 10393
10397 10396  O     19.410002  -23.694691   -4.278247     1 10397 10398
10398 10397  H     20.013838  -24.421066   -4.433144     2 10396
10399 10398  H     19.073436  -23.473079   -5.146489     2 10396
10400 10399  O      2.354748  -22.723323   -1.702403     1 10400 10401
10401 10400  H      2.424717  -22.661693   -0.749755     2 10399
10402 10401  H      1.475454  -22.400683   -1.899829     2 10399
10403 10402  O     22.692819  -21.969011   -8.646928     1 10403 10404
10404 10403  H     22.110246  -21.270990   -8.347584     2 10402
10405 10404  H     23.480840  -21.513425   -8.943061     2 10402
10406 10405  O     20.360643   -0.088218  -14.549733     1 10406 10407
10407 10406  H     21.131704    0.476911  -14.501523     2 10405
10408 10407  H     20.603386   -0.772709  -15.173255     2 10405
10409 10408  O     13.215093    3.241131  -13.294950     1 10409 10410
10410 10409  H     13.280610    3.256017  -14.249789     2 10408
10411 10410  H     12.506903    2.623520  -13.112590     2 10408
10412 10411  O      3.458119   -2.196078  -30.255661     1 10412 10413
10413 10412  H      3.975031   -2.611490  -29.565395     2 10411
10414 10413  H      2.829402   -2.867115  -30.521474     2 10411
10415 10414  O      6.211760   -7.585260  -10.561251     1 10415 10416
10416 10415  H      5.543447   -8.226021  -10.804182     2 10414
10417 10416  H      6.999211   -8.106880  -10.406122     2 10414
10418 10417  O     26.541036   -7.756498   -5.006206     1 10418 10419
10419 10418  H     26.561807   -7.678228   -5.959975     2 10417
10420 10419  H     27.423642   -8.041488   -4.769522     2 10417
10421 10420  O      2.202124    0.747482  -17.187717     1 10421 10422
10422 10421  H      2.601663    1.586124  -17.418542     2 10420
10423 10422  H      2.547479    0.131254  -17.833646     2 10420
10424 10423  O     -9.269402   18.183014   23.220801     1 10424 10425
10425 10424  H     -8.840893   17.662230   22.541540     2 10423
10426 10425  H     -8.548808   18.538796   23.740795     2 10423
10427 10426  O      1.845394    2.839470  -20.146584     1 10427 10428
10428 10427  H      2.557676    3.393874  -19.827956     2 10426
10429 10428  H      2.260422    1.996248  -20.328135     2 10426
10430 10429  O     24.557864  -17.097891   -9.922135     1 10430 10431
10431 10430  H     25.491832  -17.115620   -9.713277     2 10429
10432 10431  H     24.337366  -16.167086   -9.956974     2 10429
10433 10432  O      8.171912    2.718560  -27.257151     1 10433 10434
10434 10433  H      7.654743    2.196363  -26.643899     2 10432
10435 10434  H      9.070983    2.643646  -26.937321     2 10432
10436 10435  O     12.578936  -21.904437   -3.660804     1 10436 10437
10437 10436  H     13.302245  -21.284952   -3.757205     2 10435
10438 10437  H     11.935337  -21.625119   -4.311952     2 10435
10439 10438  O     13.901658   -6.556997  -14.001894     1 10439 10440
10440 10439  H     13.885096   -7.151854  -14.751629     2 10438
10441 10440  H     14.473759   -6.987476  -13.366583     2 10438
10442 10441  O     23.930641  -11.969225  -13.102834     1 10442 10443
10443 10442  H     24.747338  -11.538682  -12.850107     2 10441
10444 10443  H     23.250043  -11.323792  -12.911957     2 10441
10445 10444  O      5.157654  -18.074375   -0.625277     1 10445 10446
10446 10445  H      4.320148  -17.699023   -0.353384     2 10444
10447 10446  H      5.790849  -17.368636   -0.494017     2 10444
10448 10447  O    -10.757838   32.061819   11.667062     1 10448 10449
10449 10448  H    -10.201465   32.289878   12.411823     2 10447
10450 10449  H    -10.350716   31.280013   11.293882     2 10447
10451 10450  O     10.691611   -9.369956  -19.452526     1 10451 10452
10452 10451  H     10.485263   -9.239658  -18.526959     2 10450
10453 10452  H      9.870721   -9.186817  -19.909507     2 10450
10454 10453  O     22.654800   -8.069889   -2.900098     1 10454 10455
10455 10454  H     23.472681   -7.591288   -3.035169     2 10453
10456 10455  H     21.968364   -7.430908   -3.091777     2 10453
10457 10456  O    -15.374139   15.927125   22.466867     1 10457 10458
10458 10457  H    -15.046854   16.780211   22.181629     2 10456
10459 10458  H    -15.942468   16.124792   23.211287     2 10456
10460 10459  O     12.807437  -22.180343  -14.551679     1 10460 10461
10461 10460  H     12.437857  -22.873909  -14.005228     2 10459
10462 10461  H     13.361061  -22.640938  -15.182222     2 10459
10463 10462  O     32.670842   -4.486138   -9.196478     1 10463 10464
10464 10463  H     33.617364   -4.409231   -9.076431     2 10462
10465 10464  H     32.352050   -4.843372   -8.367631     2 10462
10466 10465  O    -33.138621   -1.411307   -5.355907     1 10466 10467
10467 10466  H    -33.846876   -1.377903   -5.998940     2 10465
10468 10467  H    -32.606074   -2.160094   -5.624129     2 10465
10469 10468  O     27.087070  -17.683246   -8.968389     1 10469 10470
10470 10469  H     27.963877  -17.528259   -9.319700     2 10468
10471 10470  H     27.117745  -17.326637   -8.080627     2 10468
10472 10471  O     13.127283   -9.887617  -13.283090     1 10472 10473
10473 10472  H     12.626771  -10.565628  -12.829195     2 10471
10474 10473  H     13.966503   -9.860661  -12.823510     2 10471
10475 10474  O      6.824357  -17.989608  -14.435391     1 10475 10476
10476 10475  H      7.311108  -18.049977  -13.613405     2 10474
10477 10476  H      6.437948  -18.857842  -14.549803     2 10474
10478 10477  O     10.799696  -11.392748   -8.297423     1 10478 10479
10479 10478  H     11.622328  -11.255271   -8.767112     2 10477
10480 10479  H     10.990122  -11.128273   -7.397410     2 10477
10481 10480  O     16.712839  -22.948483   -3.350240     1 10481 10482
10482 10481  H     15.988249  -23.152164   -3.941607     2 10480
10483 10482  H     17.167287  -23.782495   -3.231362     2 10480
10484 10483  O     32.065995   -6.143391   -7.072297     1 10484 10485
10485 10484  H     31.675601   -7.003051   -7.229806     2 10483
10486 10485  H     32.827631   -6.323051   -6.521058     2 10483
10487 10486  O     13.659810  -10.793965  -22.322648     1 10487 10488
10488 10487  H     14.313400  -11.406188  -22.660634     2 10486
10489 10488  H     13.722128  -10.877514  -21.371140     2 10486
10490 10489  O     32.104330    1.189374   -6.816750     1 10490 10491
10491 10490  H     31.809939    0.601904   -6.120730     2 10489
10492 10491  H     31.806699    0.771891   -7.625054     2 10489
10493 10492  O      1.816481  -22.861271  -24.641124     1 10493 10494
10494 10493  H      1.388009  -23.701750  -24.479138     2 10492
10495 10494  H      2.355555  -23.012408  -25.417518     2 10492
10496 10495  O      3.370968  -31.519970   -2.917443     1 10496 10497
10497 10496  H      3.004460  -30.645982   -2.783101     2 10495
10498 10497  H      2.630559  -32.112969   -2.789467     2 10495
10499 10498  O     14.591020  -10.145561  -15.797696     1 10499 10500
10500 10499  H     13.979973  -10.130439  -15.061066     2 10498
10501 10500  H     14.452316   -9.309028  -16.241773     2 10498
10502 10501  O      3.086066  -27.312302   -6.537338     1 10502 10503
10503 10502  H      3.859980  -27.646610   -6.083986     2 10501
10504 10503  H      2.594085  -28.096050   -6.782133     2 10501
10505 10504  O     -0.820051  -18.576233   -7.669863     1 10505 10506
10506 10505  H     -1.743311  -18.324128   -7.686183     2 10504
10507 10506  H     -0.829467  -19.528292   -7.768495     2 10504
10508 10507  O     12.440978    5.305852   -8.095934     1 10508 10509
10509 10508  H     12.114636    5.018615   -8.948711     2 10507
10510 10509  H     11.688038    5.725527   -7.679780     2 10507
10511 10510  O     23.475299    0.039636  -17.827358     1 10511 10512
10512 10511  H     23.243247    0.353284  -16.953282     2 10510
10513 10512  H     22.667804    0.123162  -18.334515     2 10510
10514 10513  O      5.242084  -28.272878   -5.095823     1 10514 10515
10515 10514  H      5.790330  -28.961850   -5.471289     2 10513
10516 10515  H      5.828937  -27.522207   -5.004564     2 10513
10517 10516  O     -4.841640  -21.197020    0.537093     1 10517 10518
10518 10517  H     -5.364523  -21.853764    0.996997     2 10516
10519 10518  H     -5.216620  -21.165015   -0.343020     2 10516
10520 10519  O      1.361358  -21.880093  -13.148034     1 10520 10521
10521 10520  H      2.162154  -22.392067  -13.261349     2 10519
10522 10521  H      0.682603  -22.397026  -13.581972     2 10519
10523 10522  O    -15.381108   26.156186   -4.539144     1 10523 10524
10524 10523  H    -16.124004   26.487846   -4.034825     2 10522
10525 10524  H    -14.804524   26.913138   -4.643097     2 10522
10526 10525  O      6.081974   -5.097125   33.472478     1 10526 10527
10527 10526  H      6.482062   -4.414333   34.010953     2 10525
10528 10527  H      5.515440   -5.577643   34.076112     2 10525
10529 10528  O      3.733606  -31.364011  -13.466620     1 10529 10530
10530 10529  H      3.165216  -32.132076  -13.409706     2 10528
10531 10530  H      4.526860  -31.616965  -12.994397     2 10528
10532 10531  O     13.606749  -20.677226  -20.091327     1 10532 10533
10533 10532  H     13.165922  -20.208328  -20.799874     2 10531
10534 10533  H     13.664709  -20.038677  -19.380605     2 10531
10535 10534  O     10.487061  -16.044388  -15.689762     1 10535 10536
10536 10535  H     10.044206  -16.188889  -14.853562     2 10534
10537 10536  H      9.776754  -15.917690  -16.318763     2 10534
10538 10537  O     -4.451718   12.085492   31.042804     1 10538 10539
10539 10538  H     -4.508814   12.005522   31.994947     2 10537
10540 10539  H     -3.787944   12.759777   30.897978     2 10537
10541 10540  O    -16.747755   14.795540   14.698135     1 10541 10542
10542 10541  H    -16.623304   13.993636   14.190500     2 10540
10543 10542  H    -17.331991   15.331100   14.161409     2 10540
10544 10543  O     15.722739   -3.997516   -7.772827     1 10544 10545
10545 10544  H     15.604049   -4.088451   -6.827377     2 10543
10546 10545  H     15.905846   -3.067099   -7.903321     2 10543
10547 10546  O     27.444261   -7.127044   -1.792397     1 10547 10548
10548 10547  H     26.521111   -6.905717   -1.669761     2 10546
10549 10548  H     27.911353   -6.307922   -1.627791     2 10546
10550 10549  O      1.998691  -32.821332  -10.703296     1 10550 10551
10551 10550  H      1.763201  -33.463742  -10.033904     2 10549
10552 10551  H      1.347314  -32.126362  -10.608663     2 10549
10553 10552  O      2.009570    3.655469  -17.460266     1 10553 10554
10554 10553  H      1.322231    4.183425  -17.053993     2 10552
10555 10554  H      1.601553    3.295007  -18.247553     2 10552
10556 10555  O    -33.700393   13.749049    2.512922     1 10556 10557
10557 10556  H    -33.288924   14.322596    1.866417     2 10555
10558 10557  H    -34.108779   13.056295    1.993746     2 10555
10559 10558  O      7.286503  -20.037413    0.586653     1 10559 10560
10560 10559  H      6.443478  -20.374651    0.283649     2 10558
10561 10560  H      7.062811  -19.269445    1.112408     2 10558
10562 10561  O     18.385964  -15.007212  -19.060377     1 10562 10563
10563 10562  H     18.679786  -15.817760  -18.644548     2 10561
10564 10563  H     18.390598  -14.360228  -18.354954     2 10561
10565 10564  O     20.761789   -8.727954  -10.891584     1 10565 10566
10566 10565  H     20.719499   -7.777626  -10.997970     2 10564
10567 10566  H     19.867485   -9.027728  -11.054644     2 10564
10568 10567  O     31.821368   -1.618859  -13.628165     1 10568 10569
10569 10568  H     32.750477   -1.479443  -13.444995     2 10567
10570 10569  H     31.776621   -1.719039  -14.579056     2 10567
10571 10570  O    -29.061028   10.408386   13.450023     1 10571 10572
10572 10571  H    -28.266446   10.941351   13.478651     2 10570
10573 10572  H    -29.036174    9.986447   12.591197     2 10570
10574 10573  O      5.321760  -13.542937  -25.849212     1 10574 10575
10575 10574  H      5.825826  -13.425657  -26.654441     2 10573
10576 10575  H      4.721440  -14.262451  -26.044523     2 10573
10577 10576  O     18.265443   -0.559843  -19.878464     1 10577 10578
10578 10577  H     18.695345   -0.654557  -20.728431     2 10576
10579 10578  H     17.749341    0.242307  -19.958622     2 10576
10580 10579  O     25.105643  -14.762786   -7.502189     1 10580 10581
10581 10580  H     24.679027  -15.393968   -6.922672     2 10579
10582 10581  H     24.670546  -13.931367   -7.313338     2 10579
10583 10582  O     15.400566   -1.278143   -1.829219     1 10583 10584
10584 10583  H     15.305824   -2.222696   -1.706443     2 10582
10585 10584  H     15.849705   -1.189255   -2.669817     2 10582
10586 10585  O     26.816892   -4.916697   -4.488009     1 10586 10587
10587 10586  H     26.606603   -5.845709   -4.393423     2 10585
10588 10587  H     27.773589   -4.886832   -4.496338     2 10585
10589 10588  O     26.293307   -8.906523  -17.842913     1 10589 10590
10590 10589  H     26.641757   -9.005955  -18.728874     2 10588
10591 10590  H     25.356847   -8.753701  -17.969091     2 10588
10592 10591  O     17.440894   -9.594106   -5.375570     1 10592 10593
10593 10592  H     17.857308  -10.453921   -5.315992     2 10591
10594 10593  H     16.561463   -9.775814   -5.706955     2 10591
10595 10594  O     10.936762   -7.272745  -15.786406     1 10595 10596
10596 10595  H     10.240267   -6.705613  -16.117295     2 10594
10597 10596  H     11.167357   -6.898502  -14.936112     2 10594
10598 10597  O    -29.815329    6.396611   17.702736     1 10598 10599
10599 10598  H    -30.010272    5.885927   18.488504     2 10597
10600 10599  H    -29.867938    5.764076   16.986243     2 10597
10601 10600  O     13.459671   -7.102569   -9.908698     1 10601 10602
10602 10601  H     13.814451   -6.866287   -9.051649     2 10600
10603 10602  H     13.441652   -6.279071  -10.396302     2 10600
10604 10603  O     17.716092   -2.718947  -15.108780     1 10604 10605
10605 10604  H     18.074598   -2.563432  -15.982576     2 10603
10606 10605  H     16.850850   -2.310029  -15.128105     2 10603
10607 10606  O     11.653950  -21.639942   -8.327937     1 10607 10608
10608 10607  H     11.274706  -21.274555   -7.528627     2 10606
10609 10608  H     11.288851  -22.522941   -8.384912     2 10606
10610 10609  O      7.633255  -12.043967  -23.398979     1 10610 10611
10611 10610  H      8.546309  -11.931789  -23.134442     2 10609
10612 10611  H      7.438751  -12.961325  -23.207005     2 10609
10613 10612  O    -26.980188   16.233165   11.017898     1 10613 10614
10614 10613  H    -27.690041   15.672212   11.330424     2 10612
10615 10614  H    -26.782293   16.805322   11.759319     2 10612
10616 10615  O     12.589477  -24.689217   -9.535860     1 10616 10617
10617 10616  H     12.369732  -25.585731   -9.789249     2 10615
10618 10617  H     11.868308  -24.416553   -8.968585     2 10615
10619 10618  O     26.628714    2.237961  -10.113835     1 10619 10620
10620 10619  H     26.131096    2.715797  -10.777371     2 10618
10621 10620  H     26.803905    2.886508   -9.431979     2 10618
10622 10621  O     17.458379    2.889327  -29.419709     1 10622 10623
10623 10622  H     17.031042    2.181941  -29.902639     2 10621
10624 10623  H     17.374552    3.653787  -29.989626     2 10621
10625 10624  O     16.685168    0.549451  -30.930114     1 10625 10626
10626 10625  H     17.445527    0.199758  -31.394659     2 10624
10627 10626  H     15.973779    0.508585  -31.569244     2 10624
10628 10627  O     18.648710  -17.562727   -8.388422     1 10628 10629
10629 10628  H     17.942590  -17.607636   -7.743744     2 10627
10630 10629  H     18.242843  -17.171573   -9.162051     2 10627
10631 10630  O     31.579212    6.098758   16.723560     1 10631 10632
10632 10631  H     31.151897    5.364080   16.283238     2 10630
10633 10632  H     31.215306    6.876552   16.300665     2 10630
10634 10633  O     -2.540524   20.852781   30.074277     1 10634 10635
10635 10634  H     -2.055489   20.911948   30.897364     2 10633
10636 10635  H     -2.152242   21.527948   29.517843     2 10633
10637 10636  O     10.293940  -12.037700  -22.682265     1 10637 10638
10638 10637  H     10.810490  -12.034675  -21.876413     2 10636
10639 10638  H     10.527964  -12.859194  -23.114250     2 10636
10640 10639  O     20.146139   -8.831855   -4.236531     1 10640 10641
10641 10640  H     19.314822   -9.300255   -4.160730     2 10639
10642 10641  H     20.704685   -9.224133   -3.565431     2 10639
10643 10642  O      6.378491  -31.390713  -13.019331     1 10643 10644
10644 10643  H      6.314456  -30.512622  -12.643714     2 10642
10645 10644  H      7.275146  -31.667608  -12.830734     2 10642
10646 10645  O     18.306187   -2.437612  -17.823749     1 10646 10647
10647 10646  H     18.066177   -3.125510  -18.444573     2 10645
10648 10647  H     18.234916   -1.625741  -18.325763     2 10645
10649 10648  O     27.876368   -4.548754  -16.146192     1 10649 10650
10650 10649  H     28.257720   -5.382708  -15.871745     2 10648
10651 10650  H     28.445274   -4.246078  -16.853982     2 10648
10652 10651  O     18.180456   -7.882069   -9.612751     1 10652 10653
10653 10652  H     17.715741   -8.407215   -8.961220     2 10651
10654 10653  H     18.164525   -8.415993  -10.407045     2 10651
10655 10654  O     27.254950    2.728915  -13.360386     1 10655 10656
10656 10655  H     26.919657    3.137900  -12.562551     2 10654
10657 10656  H     26.886767    3.253026  -14.071709     2 10654
10658 10657  O     22.622976  -27.002771   -2.402379     1 10658 10659
10659 10658  H     22.671541  -26.466743   -1.610832     2 10657
10660 10659  H     23.338089  -26.683435   -2.952716     2 10657
10661 10660  O      7.649684  -24.300946   -2.470161     1 10661 10662
10662 10661  H      6.811871  -23.849326   -2.368473     2 10660
10663 10662  H      8.058526  -24.245620   -1.606437     2 10660
10664 10663  O     28.092914   -2.089051  -12.297077     1 10664 10665
10665 10664  H     28.422308   -1.361119  -11.769967     2 10663
10666 10665  H     27.799823   -1.681749  -13.112205     2 10663
10667 10666  O     34.510739   -1.362409  -18.570672     1 10667 10668
10668 10667  H     33.980195   -2.145543  -18.424197     2 10666
10669 10668  H     33.933840   -0.634792  -18.338307     2 10666
10670 10669  O      1.222680  -13.580110  -23.242638     1 10670 10671
10671 10670  H      2.163871  -13.507237  -23.084270     2 10669
10672 10671  H      0.832387  -13.590848  -22.368688     2 10669
10673 10672  O    -11.390496   19.989596   20.102333     1 10673 10674
10674 10673  H    -12.027372   20.419807   19.531773     2 10672
10675 10674  H    -11.536175   19.053997   19.962104     2 10672
10676 10675  O     17.161109   -6.847774   -5.018767     1 10676 10677
10677 10676  H     17.210382   -7.801303   -5.086485     2 10675
10678 10677  H     17.278483   -6.667030   -4.086144     2 10675
10679 10678  O     27.368266  -14.360002   -8.896522     1 10679 10680
10680 10679  H     27.286084  -14.121002   -9.819754     2 10678
10681 10680  H     26.467390  -14.385005   -8.573986     2 10678
10682 10681  O     22.508596  -14.439270  -13.072146     1 10682 10683
10683 10682  H     22.275346  -14.723851  -12.188494     2 10681
10684 10683  H     23.204226  -13.794965  -12.940990     2 10681
10685 10684  O    -15.109717   19.430728   14.564584     1 10685 10686
10686 10685  H    -15.541048   20.200131   14.936342     2 10684
10687 10686  H    -15.815967   18.796979   14.438871     2 10684
10688 10687  O     26.201884   -8.379609  -12.283874     1 10688 10689
10689 10688  H     25.997474   -7.681330  -12.905850     2 10687
10690 10689  H     25.970626   -8.015249  -11.429478     2 10687
10691 10690  O     25.238410   -6.332316  -17.625854     1 10691 10692
10692 10691  H     25.795902   -6.522222  -18.380420     2 10690
10693 10692  H     24.346082   -6.377849  -17.969233     2 10690
10694 10693  O     -4.587700   -5.836064  -11.258224     1 10694 10695
10695 10694  H     -4.322759   -4.999883  -10.875028     2 10693
10696 10695  H     -4.011079   -6.481120  -10.848782     2 10693
10697 10696  O      6.896685  -29.057728    1.979743     1 10697 10698
10698 10697  H      7.686239  -29.287256    2.469796     2 10696
10699 10698  H      7.159320  -29.114911    1.061056     2 10696
10700 10699  O     22.529377   -8.537961  -14.968470     1 10700 10701
10701 10700  H     23.010695   -8.838271  -14.197510     2 10699
10702 10701  H     22.328767   -7.620422  -14.783782     2 10699
10703 10702  O     21.478688   -7.546630   -6.313835     1 10703 10704
10704 10703  H     20.956833   -6.807913   -6.627196     2 10702
10705 10704  H     20.987241   -7.887812   -5.566635     2 10702
10706 10705  O      2.434007   -5.362458  -19.658040     1 10706 10707
10707 10706  H      2.518600   -6.256388  -19.989649     2 10705
10708 10707  H      3.153810   -5.268838  -19.034060     2 10705
10709 10708  O      5.020014   -6.327229   -1.006462     1 10709 10710
10710 10709  H      5.968569   -6.227337   -1.087068     2 10708
10711 10710  H      4.886836   -6.640278   -0.111758     2 10708
10712 10711  O     16.560014  -18.989337   -5.408636     1 10712 10713
10713 10712  H     16.250303  -19.800064   -5.812410     2 10711
10714 10713  H     15.880758  -18.762894   -4.773367     2 10711
10715 10714  O    -17.410605    9.468257   25.421910     1 10715 10716
10716 10715  H    -16.775793    9.586391   26.128513     2 10714
10717 10716  H    -17.429089    8.523141   25.271427     2 10714
10718 10717  O     23.565748  -16.132160    0.116193     1 10718 10719
10719 10718  H     23.542951  -15.260070    0.510112     2 10717
10720 10719  H     23.380298  -16.728194    0.841854     2 10717
10721 10720  O      3.931966  -15.178619  -34.717620     1 10721 10722
10722 10721  H      4.236956  -15.279090  -33.815889     2 10720
10723 10722  H      4.313814  -14.350755  -35.009281     2 10720
10724 10723  O      2.819738  -21.524495  -22.568188     1 10724 10725
10725 10724  H      3.449444  -22.080317  -22.109098     2 10723
10726 10725  H      2.487927  -22.073758  -23.278430     2 10723
10727 10726  O     10.595864   -0.985158  -11.123992     1 10727 10728
10728 10727  H     11.481855   -0.953464  -11.484889     2 10726
10729 10728  H     10.066687   -0.481333  -11.742347     2 10726
10730 10729  O      4.136926   35.322356  -10.412927     1 10730 10731
10731 10730  H      4.999053   35.707250  -10.570487     2 10729
10732 10731  H      4.095134   34.574940  -11.009461     2 10729
10733 10732  O     24.158354  -16.781162   -5.754201     1 10733 10734
10734 10733  H     23.245307  -17.007813   -5.577550     2 10732
10735 10734  H     24.475073  -16.403858   -4.933493     2 10732
10736 10735  O     24.433337    0.579616   -9.931469     1 10736 10737
10737 10736  H     25.143243    1.143700  -10.238185     2 10735
10738 10737  H     24.605347    0.464026   -8.996974     2 10735
10739 10738  O    -16.812202    6.626763   25.782386     1 10739 10740
10740 10739  H    -16.868837    6.007735   25.054492     2 10738
10741 10740  H    -15.999439    6.395060   26.231786     2 10738
10742 10741  O     19.161232  -17.254727  -17.950022     1 10742 10743
10743 10742  H     19.081187  -17.726111  -17.120793     2 10741
10744 10743  H     20.073164  -17.382204  -18.211483     2 10741
10745 10744  O    -14.703326   23.519119   13.754998     1 10745 10746
10746 10745  H    -15.216694   22.728905   13.923062     2 10744
10747 10746  H    -13.800450   23.263427   13.943860     2 10744
10748 10747  O     10.888913    1.833869   -2.187280     1 10748 10749
10749 10748  H     11.665475    1.280844   -2.272990     2 10747
10750 10749  H     11.132018    2.489278   -1.533392     2 10747
10751 10750  O      4.530118  -25.411487  -22.955468     1 10751 10752
10752 10751  H      5.366967  -25.410963  -23.420135     2 10750
10753 10752  H      4.686434  -24.874034  -22.178975     2 10750
10754 10753  O     29.039523   -4.852859  -20.254661     1 10754 10755
10755 10754  H     28.560537   -5.671722  -20.382207     2 10753
10756 10755  H     29.953508   -5.080387  -20.425235     2 10753
10757 10756  O      7.676392   -8.473604   -4.479275     1 10757 10758
10758 10757  H      7.545449   -9.251891   -3.937650     2 10756
10759 10758  H      7.271439   -7.763628   -3.981100     2 10756
10760 10759  O     12.608401   -4.933357  -17.253124     1 10760 10761
10761 10760  H     12.355263   -4.466728  -16.456625     2 10759
10762 10761  H     12.782635   -4.241638  -17.891401     2 10759
10763 10762  O     -7.863018   15.735921   29.444014     1 10763 10764
10764 10763  H     -7.563045   15.415488   28.593385     2 10762
10765 10764  H     -8.686890   16.184833   29.254426     2 10762
10766 10765  O     25.523319  -24.482531    0.903755     1 10766 10767
10767 10766  H     26.466155  -24.603635    1.016126     2 10765
10768 10767  H     25.444372  -23.904357    0.144998     2 10765
10769 10768  O     -5.596420   15.367091   30.745772     1 10769 10770
10770 10769  H     -6.393841   15.396236   30.217092     2 10768
10771 10770  H     -4.891236   15.245921   30.109954     2 10768
10772 10771  O      4.148342  -22.153670    3.791960     1 10772 10773
10773 10772  H      4.694264  -22.413493    3.049874     2 10771
10774 10773  H      4.198715  -22.893258    4.397520     2 10771
10775 10774  O     18.876342  -27.828467   -6.670008     1 10775 10776
10776 10775  H     19.258113  -28.689685   -6.839668     2 10774
10777 10776  H     19.345588  -27.237673   -7.259079     2 10774
10778 10777  O     11.136726  -24.046788   -4.823678     1 10778 10779
10779 10778  H     11.975932  -24.365065   -4.491014     2 10777
10780 10779  H     10.781385  -23.516477   -4.110421     2 10777
10781 10780  O     18.517846   -3.733948  -11.320593     1 10781 10782
10782 10781  H     17.678671   -4.168343  -11.167894     2 10780
10783 10782  H     18.354679   -2.815093  -11.107726     2 10780
10784 10783  O     28.570093  -14.283110   -5.688661     1 10784 10785
10785 10784  H     28.379434  -14.454025   -4.766344     2 10783
10786 10785  H     29.520660  -14.175449   -5.721276     2 10783
10787 10786  O     25.418911   -3.089856  -18.971252     1 10787 10788
10788 10787  H     25.585893   -3.159727  -18.031322     2 10786
10789 10788  H     25.971746   -2.363704  -19.259883     2 10786
10790 10789  O     16.189587  -14.536342   -6.995171     1 10790 10791
10791 10790  H     16.168961  -15.456688   -7.257413     2 10789
10792 10791  H     16.140353  -14.050981   -7.818720     2 10789
10793 10792  O    -16.175973   -1.574961   35.208774     1 10793 10794
10794 10793  H    -16.955532   -1.537209   34.654612     2 10792
10795 10794  H    -15.955434   -2.505510   35.249671     2 10792
10796 10795  O     35.333026  -15.189644    0.538384     1 10796 10797
10797 10796  H     34.924362  -15.700293    1.237285     2 10795
10798 10797  H     34.627602  -15.035157   -0.089901     2 10795
10799 10798  O      5.996268  -12.627895   -9.747953     1 10799 10800
10800 10799  H      6.057950  -12.993483   -8.865472     2 10798
10801 10800  H      6.113841  -11.685780   -9.626186     2 10798
10802 10801  O    -17.891797   18.179646   15.153357     1 10802 10803
10803 10802  H    -17.771382   18.314295   16.093357     2 10801
10804 10803  H    -18.758510   18.541253   14.968207     2 10801
10805 10804  O      5.560789  -24.502405  -18.734844     1 10805 10806
10806 10805  H      5.472137  -25.450171  -18.634285     2 10804
10807 10806  H      6.241154  -24.257139  -18.107803     2 10804
10808 10807  O    -12.766554    6.981363   31.410663     1 10808 10809
10809 10808  H    -12.885046    7.306408   30.518174     2 10807
10810 10809  H    -11.886054    7.266431   31.654972     2 10807
10811 10810  O     -3.585453  -34.367370   -4.076021     1 10811 10812
10812 10811  H     -4.285444  -34.718776   -4.626256     2 10810
10813 10812  H     -3.112019  -35.139937   -3.767424     2 10810
10814 10813  O     10.974849   -0.279370  -15.342850     1 10814 10815
10815 10814  H     10.340792   -0.893985  -14.973457     2 10813
10816 10815  H     11.105996    0.372766  -14.654555     2 10813
10817 10816  O     12.611803  -17.550647  -16.390269     1 10817 10818
10818 10817  H     12.014068  -16.816448  -16.249214     2 10816
10819 10818  H     13.124632  -17.600994  -15.583606     2 10816
10820 10819  O    -12.913925   26.599954    7.661765     1 10820 10821
10821 10820  H    -12.196066   27.052965    8.104135     2 10819
10822 10821  H    -12.995421   27.045470    6.818494     2 10819
10823 10822  O     -0.967314  -23.694903  -17.532827     1 10823 10824
10824 10823  H     -1.098674  -24.613901  -17.299546     2 10822
10825 10824  H     -0.560762  -23.722910  -18.398946     2 10822
10826 10825  O     19.879634   -4.912748  -24.338591     1 10826 10827
10827 10826  H     19.202134   -4.279281  -24.575118     2 10825
10828 10827  H     19.603693   -5.727364  -24.758697     2 10825
10829 10828  O      4.880914  -20.894158   -0.253087     1 10829 10830
10830 10829  H      4.625387  -20.174898   -0.830670     2 10828
10831 10830  H      4.091566  -21.087986    0.252473     2 10828
10832 10831  O     -5.911788   -7.422831   -4.727770     1 10832 10833
10833 10832  H     -5.287796   -7.752275   -4.080984     2 10831
10834 10833  H     -5.412012   -7.379409   -5.542981     2 10831
10835 10834  O     26.221212  -17.963889   -0.418281     1 10835 10836
10836 10835  H     26.119822  -18.649906   -1.078079     2 10834
10837 10836  H     25.592868  -17.289054   -0.675215     2 10834
10838 10837  O     19.688732   -2.709095   -7.227738     1 10838 10839
10839 10838  H     20.124135   -1.951283   -7.618093     2 10837
10840 10839  H     19.198020   -3.102089   -7.949535     2 10837
10841 10840  O     -5.890286   15.450049   27.083059     1 10841 10842
10842 10841  H     -5.105997   14.967984   26.820886     2 10840
10843 10842  H     -5.599797   16.359128   27.156708     2 10840
10844 10843  O     -1.599084   31.530292   19.636739     1 10844 10845
10845 10844  H     -2.403295   31.190858   19.243980     2 10843
10846 10845  H     -0.906130   30.970453   19.286558     2 10843
10847 10846  O     31.491490   14.124897    8.125259     1 10847 10848
10848 10847  H     30.931706   13.469699    7.708620     2 10846
10849 10848  H     32.363238   13.958842    7.766492     2 10846
10850 10849  O      5.875167  -16.416090   -7.592675     1 10850 10851
10851 10850  H      6.087779  -15.606222   -7.128842     2 10849
10852 10851  H      6.605815  -16.545197   -8.197420     2 10849
10853 10852  O      5.699886  -30.147307   -6.972870     1 10853 10854
10854 10853  H      5.639826  -30.591991   -7.818376     2 10852
10855 10854  H      5.126525  -30.651291   -6.395386     2 10852
10856 10855  O     22.219981  -18.643037   -4.571172     1 10856 10857
10857 10856  H     22.581887  -18.503627   -3.696060     2 10855
10858 10857  H     21.404253  -18.142242   -4.576102     2 10855
10859 10858  O     19.301907  -13.949090  -16.008387     1 10859 10860
10860 10859  H     19.386886  -13.052366  -15.684510     2 10858
10861 10860  H     20.200458  -14.225204  -16.188938     2 10858
10862 10861  O     24.075644  -20.855905   -0.019310     1 10862 10863
10863 10862  H     24.702668  -20.660820   -0.715739     2 10861
10864 10863  H     23.518153  -21.543276   -0.383941     2 10861
10865 10864  O     20.662360  -13.496504  -10.087703     1 10865 10866
10866 10865  H     19.987608  -13.820029  -10.684589     2 10864
10867 10866  H     21.366862  -14.141542  -10.149627     2 10864
10868 10867  O     12.508498   -3.146091  -23.765221     1 10868 10869
10869 10868  H     13.354685   -3.205820  -23.321791     2 10867
10870 10869  H     12.641728   -3.598103  -24.598388     2 10867
10871 10870  O     12.782179   -0.434641   -1.667900     1 10871 10872
10872 10871  H     12.842605    0.011719   -0.823304     2 10870
10873 10872  H     13.596864   -0.932658   -1.734972     2 10870
10874 10873  O     20.826672   -5.923120   -3.213241     1 10874 10875
10875 10874  H     19.954441   -5.570250   -3.037377     2 10873
10876 10875  H     21.302212   -5.197290   -3.617300     2 10873
10877 10876  O     15.677203   -7.759149   -7.888857     1 10877 10878
10878 10877  H     15.628454   -7.559470   -6.953986     2 10876
10879 10878  H     15.976786   -8.667544   -7.924930     2 10876
10880 10879  O     -8.529553   -8.667947   35.801571     1 10880 10881
10881 10880  H     -8.827467   -9.375220   35.229518     2 10879
10882 10881  H     -7.864761   -8.208347   35.288686     2 10879
10883 10882  O     19.034893   -5.353761   -9.103384     1 10883 10884
10884 10883  H     18.912162   -4.953360   -9.964109     2 10882
10885 10884  H     18.565548   -6.186280   -9.156853     2 10882
10886 10885  O      0.439021  -28.340605  -18.831834     1 10886 10887
10887 10886  H      0.515231  -28.939475  -19.574652     2 10885
10888 10887  H      1.148347  -28.597509  -18.242692     2 10885
10889 10888  O      3.858979  -32.785473  -17.350880     1 10889 10890
10890 10889  H      3.494779  -33.198406  -16.567888     2 10888
10891 10890  H      4.647420  -32.339091  -17.042115     2 10888
10892 10891  O    -30.497899   13.819698    9.767868     1 10892 10893
10893 10892  H    -30.697859   14.057004    8.862366     2 10891
10894 10893  H    -30.959567   12.992780    9.906794     2 10891
10895 10894  O     19.363676   -1.028382  -22.667769     1 10895 10896
10896 10895  H     19.744019   -1.150648  -23.537608     2 10894
10897 10896  H     18.795326   -0.263685  -22.759679     2 10894
10898 10897  O     27.435970  -18.048059   -4.090634     1 10898 10899
10899 10898  H     27.591193  -17.726004   -4.978564     2 10897
10900 10899  H     28.103075  -17.614831   -3.558171     2 10897
10901 10900  O      3.281603  -25.273635  -16.031625     1 10901 10902
10902 10901  H      3.198441  -25.587870  -15.131307     2 10900
10903 10902  H      3.940197  -25.845704  -16.425608     2 10900
10904 10903  O     22.873505    1.791803  -26.538015     1 10904 10905
10905 10904  H     22.642402    2.695818  -26.751509     2 10903
10906 10905  H     22.919469    1.775207  -25.582063     2 10903
10907 10906  O     32.909098   -5.903450  -11.505983     1 10907 10908
10908 10907  H     32.597800   -5.262364  -10.866973     2 10906
10909 10908  H     33.664373   -5.484114  -11.918231     2 10906
10910 10909  O     30.928322   -1.969875  -16.059401     1 10910 10911
10911 10910  H     30.318431   -2.491005  -16.581597     2 10909
10912 10911  H     30.570860   -1.082377  -16.087692     2 10909
10913 10912  O     30.052763  -20.780560   -2.891348     1 10913 10914
10914 10913  H     30.395488  -20.801565   -3.784842     2 10912
10915 10914  H     30.408145  -21.568119   -2.479418     2 10912
10916 10915  O     21.355820   -5.114027  -20.415125     1 10916 10917
10917 10916  H     21.450307   -4.163572  -20.477880     2 10915
10918 10917  H     20.433379   -5.277016  -20.612020     2 10915
10919 10918  O      1.585882   -8.478389   -6.847125     1 10919 10920
10920 10919  H      1.577325   -8.672974   -5.909951     2 10918
10921 10920  H      2.111429   -9.179221   -7.232956     2 10918
10922 10921  O      2.853533   -1.336756   -3.882418     1 10922 10923
10923 10922  H      3.710782   -0.933157   -4.018299     2 10921
10924 10923  H      2.542481   -1.542078   -4.764076     2 10921
10925 10924  O     17.721164   -3.205138  -24.095841     1 10925 10926
10926 10925  H     17.252381   -3.880964  -23.606215     2 10924
10927 10926  H     18.049254   -2.606617  -23.424751     2 10924
10928 10927  O     30.056922  -14.456865   -8.375040     1 10928 10929
10929 10928  H     29.101797  -14.413111   -8.420358     2 10927
10930 10929  H     30.347930  -13.568748   -8.581907     2 10927
10931 10930  O      4.822944  -22.762377  -20.778224     1 10931 10932
10932 10931  H      5.005182  -23.436633  -20.123701     2 10930
10933 10932  H      4.666374  -21.968148  -20.267424     2 10930
10934 10933  O      4.184977  -22.822752  -12.820388     1 10934 10935
10935 10934  H      4.449651  -23.514539  -12.214081     2 10933
10936 10935  H      4.849187  -22.142005  -12.712495     2 10933
10937 10936  O      7.644067  -17.300962  -10.664912     1 10937 10938
10938 10937  H      6.726146  -17.034678  -10.612526     2 10936
10939 10938  H      8.010753  -17.067378   -9.812144     2 10936
10940 10939  O      9.145388  -28.170426   -5.471885     1 10940 10941
10941 10940  H      9.359041  -27.855224   -6.350082     2 10939
10942 10941  H      8.442032  -27.593387   -5.174315     2 10939
10943 10942  O     24.914472   -6.048630  -13.344003     1 10943 10944
10944 10943  H     24.081707   -5.631942  -13.565599     2 10942
10945 10944  H     25.574748   -5.383101  -13.537241     2 10942
10946 10945  O    -16.801187   12.112376   19.423565     1 10946 10947
10947 10946  H    -16.128542   12.793077   19.444220     2 10945
10948 10947  H    -17.100155   12.097925   18.514367     2 10945
10949 10948  O     21.785084  -15.193665    2.488637     1 10949 10950
10950 10949  H     21.396971  -15.699803    3.202377     2 10948
10951 10950  H     21.517448  -15.655241    1.693936     2 10948
10952 10951  O      2.422788  -15.442284  -16.990027     1 10952 10953
10953 10952  H      2.197372  -14.745766  -16.373357     2 10951
10954 10953  H      2.984681  -16.033638  -16.489221     2 10951
10955 10954  O     -1.460120  -13.013362  -26.962372     1 10955 10956
10956 10955  H     -1.585211  -13.852511  -26.519188     2 10954
10957 10956  H     -1.315903  -13.245589  -27.879707     2 10954
10958 10957  O      2.583978    2.035430  -30.610987     1 10958 10959
10959 10958  H      2.507558    1.269192  -30.042419     2 10957
10960 10959  H      3.480516    2.343717  -30.479045     2 10957
10961 10960  O     10.358501  -16.486238  -26.137046     1 10961 10962
10962 10961  H      9.524075  -16.133628  -25.827803     2 10960
10963 10962  H     10.113914  -17.162123  -26.769175     2 10960
10964 10963  O     26.936207  -11.220908  -13.216969     1 10964 10965
10965 10964  H     26.787899  -10.959174  -14.125666     2 10963
10966 10965  H     26.729160  -10.438978  -12.705159     2 10963
10967 10966  O      5.085546  -11.409017  -24.201325     1 10967 10968
10968 10967  H      4.916045  -11.896431  -25.007507     2 10966
10969 10968  H      5.957932  -11.692865  -23.928189     2 10966
10970 10969  O     25.733459   -3.291161   -6.294137     1 10970 10971
10971 10970  H     26.111049   -3.831020   -5.599725     2 10969
10972 10971  H     26.311383   -3.427203   -7.044956     2 10969
10973 10972  O     12.608599   -4.516633  -26.268585     1 10973 10974
10974 10973  H     12.978440   -3.968029  -26.960310     2 10972
10975 10974  H     13.025510   -5.369655  -26.390114     2 10972
10976 10975  O    -19.645070   25.264452    6.785198     1 10976 10977
10977 10976  H    -19.115382   26.045091    6.947262     2 10975
10978 10977  H    -19.108861   24.539618    7.106644     2 10975
10979 10978  O      3.324069   -1.581006  -18.900458     1 10979 10980
10980 10979  H      3.811844   -1.645584  -18.079399     2 10978
10981 10980  H      3.189305   -2.489056  -19.171596     2 10978
10982 10981  O     25.587930  -15.399196  -12.868679     1 10982 10983
10983 10982  H     26.032869  -16.243306  -12.944439     2 10981
10984 10983  H     25.029192  -15.351946  -13.644443     2 10981
10985 10984  O      7.235127  -12.167946    1.435722     1 10985 10986
10986 10985  H      7.348775  -13.104601    1.596945     2 10984
10987 10986  H      7.415070  -11.755448    2.280528     2 10984
10988 10987  O     -0.648403  -30.277610  -15.156478     1 10988 10989
10989 10988  H     -1.378795  -30.235251  -15.773700     2 10987
10990 10989  H     -0.189312  -31.086389  -15.383072     2 10987
10991 10990  O     10.463577   -8.318827  -12.324608     1 10991 10992
10992 10991  H     10.314040   -8.359938  -11.380056     2 10990
10993 10992  H     11.356767   -8.642879  -12.440508     2 10990
10994 10993  O     11.276869   -3.721421  -15.363802     1 10994 10995
10995 10994  H     10.520899   -3.171711  -15.570101     2 10993
10996 10995  H     10.962045   -4.317089  -14.683878     2 10993
10997 10996  O     13.172580   -1.124888  -12.363770     1 10997 10998
10998 10997  H     13.636957   -1.785993  -12.877119     2 10996
10999 10998  H     13.280023   -0.314846  -12.862287     2 10996
11000 10999  O      4.666509   -0.787963  -26.405677     1 11000 11001
11001 11000  H      4.407498   -1.566449  -26.898733     2 10999
11002 11001  H      3.960903   -0.659631  -25.771733     2 10999
11003 11002  O    -19.890620   21.981853    8.436696     1 11003 11004
11004 11003  H    -19.410325   22.181569    7.633166     2 11002
11005 11004  H    -20.745938   21.675627    8.135217     2 11002
11006 11005  O    -17.465098   12.775452   16.835913     1 11006 11007
11007 11006  H    -17.604461   11.958208   16.357456     2 11005
11008 11007  H    -17.965712   13.428336   16.346668     2 11005
11009 11008  O     25.664725  -13.374709   -1.841666     1 11009 11010
11010 11009  H     24.981789  -13.678734   -1.243838     2 11008
11011 11010  H     25.187646  -13.044373   -2.602919     2 11008
11012 11011  O     17.350479   -7.939356  -26.157025     1 11012 11013
11013 11012  H     17.142877   -8.775697  -25.740292     2 11011
11014 11013  H     18.197279   -7.690349  -25.786677     2 11011
11015 11014  O     33.013708   -9.536806  -10.591209     1 11015 11016
11016 11015  H     32.544980   -8.717608  -10.431709     2 11014
11017 11016  H     33.108442   -9.577733  -11.542830     2 11014
11018 11017  O     10.051465   -2.603586  -29.669403     1 11018 11019
11019 11018  H      9.127543   -2.436141  -29.855313     2 11017
11020 11019  H     10.052779   -3.427767  -29.182623     2 11017
11021 11020  O      6.834961    3.509935   36.243466     1 11021 11022
11022 11021  H      6.354146    3.520449   35.415856     2 11020
11023 11022  H      7.710052    3.201168   36.008710     2 11020
11024 11023  O     16.967489  -12.032413  -18.896127     1 11024 11025
11025 11024  H     17.196314  -11.254290  -19.404452     2 11023
11026 11025  H     16.058819  -11.887965  -18.632146     2 11023
11027 11026  O     18.719951    1.100290  -27.791158     1 11027 11028
11028 11027  H     18.158835    0.846688  -27.058310     2 11026
11029 11028  H     18.198215    1.732657  -28.285259     2 11026
11030 11029  O     -3.862924   32.806768   17.688762     1 11030 11031
11031 11030  H     -3.744883   31.940468   17.299118     2 11029
11032 11031  H     -4.682608   32.739954   18.178543     2 11029
11033 11032  O     -2.293157   -9.324657   36.216922     1 11033 11034
11034 11033  H     -1.993367   -9.288291   37.125237     2 11032
11035 11034  H     -1.962039  -10.160438   35.888195     2 11032
11036 11035  O     15.168951   -3.548762  -31.893817     1 11036 11037
11037 11036  H     15.642746   -3.712844  -31.078448     2 11035
11038 11037  H     14.256396   -3.444605  -31.624322     2 11035
11039 11038  O    -26.279711   20.557379    6.359352     1 11039 11040
11040 11039  H    -26.273047   21.312411    5.771037     2 11038
11041 11040  H    -25.464340   20.632243    6.855131     2 11038
11042 11041  O      0.731238  -12.399560  -16.246343     1 11042 11043
11043 11042  H      1.043044  -11.687007  -16.804264     2 11041
11044 11043  H      1.524866  -12.871127  -15.993338     2 11041
11045 11044  O      5.545415  -13.211416   -0.327774     1 11045 11046
11046 11045  H      6.343919  -12.832423    0.039632     2 11044
11047 11046  H      5.441606  -14.044527    0.131988     2 11044
11048 11047  O     23.603686   -4.213550   -4.560339     1 11048 11049
11049 11048  H     24.261744   -4.205487   -5.255412     2 11047
11050 11049  H     22.842334   -3.779808   -4.945623     2 11047
11051 11050  O      0.051046  -12.629972  -12.163553     1 11051 11052
11052 11051  H     -0.709412  -12.453055  -12.717299     2 11050
11053 11052  H     -0.080243  -12.078547  -11.392239     2 11050
11054 11053  O      5.250463  -15.775592  -14.994407     1 11054 11055
11055 11054  H      5.781052  -16.492651  -14.647227     2 11053
11056 11055  H      4.671550  -15.533610  -14.271540     2 11053
11057 11056  O    -23.341859    9.072501   17.881906     1 11057 11058
11058 11057  H    -23.901955    9.821418   18.085983     2 11056
11059 11058  H    -22.691721    9.060583   18.584338     2 11056
11060 11059  O      9.702899  -30.464539   -3.921610     1 11060 11061
11061 11060  H      9.194800  -31.254626   -4.105541     2 11059
11062 11061  H      9.515187  -29.881784   -4.657403     2 11059
11063 11062  O     13.618707  -11.038971   -9.245910     1 11063 11064
11064 11063  H     13.731311  -10.471528  -10.008510     2 11062
11065 11064  H     13.751264  -11.924579   -9.584082     2 11062
11066 11065  O     12.430298   -3.684735  -19.894690     1 11066 11067
11067 11066  H     12.937986   -3.181229  -20.531059     2 11065
11068 11067  H     11.618433   -3.901628  -20.353018     2 11065
11069 11068  O     22.308744   -9.351383   -8.077146     1 11069 11070
11070 11069  H     21.555923   -9.166915   -8.638806     2 11068
11071 11070  H     22.264083   -8.686563   -7.389941     2 11068
11072 11071  O     15.542247   -4.932906  -20.271214     1 11072 11073
11073 11072  H     15.201738   -4.306383  -19.632657     2 11071
11074 11073  H     15.385836   -5.789566  -19.873847     2 11071
11075 11074  O     12.515331  -14.052250  -15.701834     1 11075 11076
11076 11075  H     11.830130  -14.720340  -15.721500     2 11074
11077 11076  H     13.305061  -14.526046  -15.440921     2 11074
11078 11077  O     10.454066   -5.694955  -13.460084     1 11078 11079
11079 11078  H     10.579421   -6.510825  -12.975446     2 11077
11080 11079  H     10.090481   -5.086907  -12.816411     2 11077
11081 11080  O    -21.133070   10.471348   21.829589     1 11081 11082
11082 11081  H    -20.583677   10.253765   22.582621     2 11080
11083 11082  H    -21.927658    9.952398   21.954299     2 11080
11084 11083  O      5.004633  -27.079493  -18.121276     1 11084 11085
11085 11084  H      4.509111  -27.560691  -18.783950     2 11083
11086 11085  H      5.126692  -27.707869  -17.409604     2 11083
11087 11086  O     23.427914  -14.197829  -10.136126     1 11087 11088
11088 11087  H     23.610126  -13.747184   -9.311535     2 11086
11089 11088  H     23.921479  -13.706104  -10.792504     2 11086
11090 11089  O      6.954419   -9.815536  -28.541343     1 11090 11091
11091 11090  H      7.734408  -10.148836  -28.984920     2 11089
11092 11091  H      7.290351   -9.176160  -27.913188     2 11089
11093 11092  O      3.751549   -1.013743  -12.989380     1 11093 11094
11094 11093  H      3.115087   -0.503505  -13.490184     2 11092
11095 11094  H      3.979660   -1.744016  -13.564618     2 11092
11096 11095  O      6.162424   -6.642303   -6.585885     1 11096 11097
11097 11096  H      5.561751   -6.731703   -5.845999     2 11095
11098 11097  H      6.088924   -5.723790   -6.845047     2 11095
11099 11098  O     18.749208  -12.029296   -4.911781     1 11099 11100
11100 11099  H     18.942142  -12.388533   -5.777781     2 11098
11101 11100  H     19.330641  -12.505870   -4.319291     2 11098
11102 11101  O     21.516800  -20.210267   -6.802811     1 11102 11103
11103 11102  H     21.714302  -19.742336   -5.991476     2 11101
11104 11103  H     20.725708  -20.711305   -6.604399     2 11101
11105 11104  O      9.837046  -21.425357   -0.254288     1 11105 11106
11106 11105  H     10.107410  -21.931222    0.512025     2 11104
11107 11106  H      9.085087  -20.915804    0.047615     2 11104
11108 11107  O      7.455274  -14.027939  -20.010708     1 11108 11109
11109 11108  H      6.744089  -14.397497  -19.487378     2 11107
11110 11109  H      8.102135  -13.739409  -19.366850     2 11107
11111 11110  O     19.868052   -6.787000  -17.901336     1 11111 11112
11112 11111  H     20.774619   -6.480139  -17.887040     2 11110
11113 11112  H     19.370287   -6.048679  -18.252538     2 11110
11114 11113  O      7.205136  -14.834787  -12.586519     1 11114 11115
11115 11114  H      7.955790  -14.676170  -12.014162     2 11113
11116 11115  H      6.557660  -15.256748  -12.021758     2 11113
11117 11116  O     33.695551    2.101483  -10.462507     1 11117 11118
11118 11117  H     34.098446    1.336848  -10.051118     2 11116
11119 11118  H     33.639174    2.749844   -9.760595     2 11116
11120 11119  O     10.769416  -19.779662  -10.259495     1 11120 11121
11121 11120  H     10.627177  -20.476471  -10.900164     2 11119
11122 11121  H     11.101931  -20.231145   -9.483719     2 11119
11123 11122  O     -3.586142   21.913208   21.874160     1 11123 11124
11124 11123  H     -4.268711   22.021345   21.211862     2 11122
11125 11124  H     -3.065485   21.172516   21.563477     2 11122
11126 11125  O      5.671465  -16.699696  -21.800895     1 11126 11127
11127 11126  H      6.449101  -16.164067  -21.957790     2 11125
11128 11127  H      5.959479  -17.596544  -21.971020     2 11125
11129 11128  O     11.357127   -2.508615   -9.029610     1 11129 11130
11130 11129  H     10.539963   -2.320914   -8.567830     2 11128
11131 11130  H     11.230017   -2.137637   -9.902794     2 11128
11132 11131  O     10.244379   -9.322295  -27.597933     1 11132 11133
11133 11132  H     11.194709   -9.300308  -27.485587     2 11131
11134 11133  H      9.909789   -9.623863  -26.753339     2 11131
11135 11134  O     14.522349   -7.033137   -2.542779     1 11135 11136
11136 11135  H     15.418445   -7.039383   -2.206317     2 11134
11137 11136  H     14.411762   -6.158128   -2.914749     2 11134
11138 11137  O     16.594681  -21.433710   -7.355942     1 11138 11139
11139 11138  H     16.001651  -21.341669   -8.101647     2 11137
11140 11139  H     16.762868  -22.374218   -7.297727     2 11137
11141 11140  O     15.128484  -12.615499  -13.825788     1 11141 11142
11142 11141  H     15.851537  -11.993655  -13.907871     2 11140
11143 11142  H     15.193478  -13.163702  -14.607760     2 11140
11144 11143  O     25.543441  -10.454893   -3.048086     1 11144 11145
11145 11144  H     25.119333   -9.672374   -3.400262     2 11143
11146 11145  H     24.998771  -11.180714   -3.352631     2 11143
11147 11146  O      8.781423  -10.509911   -0.059859     1 11147 11148
11148 11147  H      8.373110  -11.276840    0.341803     2 11146
11149 11148  H      8.591960   -9.792696    0.545069     2 11146
11150 11149  O    -33.738448   -4.459029   -8.313504     1 11150 11151
11151 11150  H    -33.126213   -4.984106   -8.828958     2 11149
11152 11151  H    -33.716006   -3.593890   -8.722481     2 11149
11153 11152  O     10.626063  -31.135863   -1.130685     1 11153 11154
11154 11153  H     10.137056  -31.212677   -1.949955     2 11152
11155 11154  H     11.462410  -30.746542   -1.385996     2 11152
11156 11155  O     33.739229  -11.416141   -1.251674     1 11156 11157
11157 11156  H     33.619901  -10.700791   -1.876388     2 11155
11158 11157  H     33.897626  -12.186868   -1.796763     2 11155
11159 11158  O     10.480047   -5.309859   -9.859592     1 11159 11160
11160 11159  H     10.856934   -6.144562   -9.581279     2 11158
11161 11160  H     10.234996   -4.873278   -9.043762     2 11158
11162 11161  O    -23.361248   28.324596    1.396001     1 11162 11163
11163 11162  H    -23.294467   29.075088    1.986369     2 11161
11164 11163  H    -24.279793   28.311824    1.127035     2 11161
11165 11164  O     11.396741   -5.160891   31.354484     1 11165 11166
11166 11165  H     11.122578   -4.320136   30.988155     2 11164
11167 11166  H     12.310093   -5.254250   31.083738     2 11164
11168 11167  O      1.414987  -10.864365  -22.234794     1 11168 11169
11169 11168  H      0.865259  -11.473140  -22.728174     2 11167
11170 11169  H      0.997774  -10.011534  -22.356633     2 11167
11171 11170  O     12.797424   -2.254051   -4.241734     1 11171 11172
11172 11171  H     12.199540   -1.717128   -4.761810     2 11170
11173 11172  H     12.595248   -2.027693   -3.333924     2 11170
11174 11173  O    -33.206134   12.512766   -1.222414     1 11174 11175
11175 11174  H    -33.323478   11.803828   -0.590062     2 11173
11176 11175  H    -34.093442   12.824044   -1.401364     2 11173
11177 11176  O     -1.668489   25.186268   27.021143     1 11177 11178
11178 11177  H     -0.878029   25.390284   26.521361     2 11176
11179 11178  H     -2.344765   25.746065   26.639684     2 11176
11180 11179  O    -20.211478   10.759016   17.016435     1 11180 11181
11181 11180  H    -20.291238    9.876040   17.377299     2 11179
11182 11181  H    -19.527294   10.685446   16.351070     2 11179
11183 11182  O     15.389536   -7.223169  -18.601618     1 11183 11184
11184 11183  H     14.901063   -7.440401  -17.807619     2 11182
11185 11184  H     14.904614   -7.652165  -19.306631     2 11182
11186 11185  O     16.819003  -10.302523   -8.826445     1 11186 11187
11187 11186  H     16.400489  -10.987339   -8.304809     2 11185
11188 11187  H     17.756405  -10.478730   -8.746062     2 11185
11189 11188  O     12.721728   -1.263290  -17.368826     1 11189 11190
11190 11189  H     12.230771   -1.881008  -17.910690     2 11188
11191 11190  H     12.150392   -1.094535  -16.619607     2 11188
11192 11191  O     16.348512  -18.352662  -12.896582     1 11192 11193
11193 11192  H     16.196235  -19.158619  -12.403147     2 11191
11194 11193  H     16.176118  -18.592501  -13.807070     2 11191
11195 11194  O     16.127461  -20.163208  -16.331732     1 11195 11196
11196 11195  H     16.693495  -19.809073  -17.017608     2 11194
11197 11196  H     16.591533  -20.937614  -16.013670     2 11194
11198 11197  O      9.162195   -5.460268   -7.360235     1 11198 11199
11199 11198  H      9.729847   -5.991129   -6.801495     2 11197
11200 11199  H      8.524926   -6.080937   -7.713633     2 11197
11201 11200  O      9.304841  -15.056977   -2.707602     1 11201 11202
11202 11201  H      9.744119  -15.907151   -2.729311     2 11200
11203 11202  H      9.395947  -14.762847   -1.801281     2 11200
11204 11203  O      3.744947  -20.076908  -15.999471     1 11204 11205
11205 11204  H      4.321298  -20.781465  -16.295529     2 11203
11206 11205  H      2.919850  -20.232725  -16.459002     2 11203
11207 11206  O     18.549471   -5.250320  -20.522841     1 11207 11208
11208 11207  H     17.921660   -5.584659  -19.882292     2 11206
11209 11208  H     18.021828   -4.725080  -21.124462     2 11206
11210 11209  O     12.896625  -18.764060   -1.750500     1 11210 11211
11211 11210  H     13.318313  -18.035702   -1.294534     2 11209
11212 11211  H     12.704739  -19.399876   -1.061189     2 11209
11213 11212  O      6.490556  -10.196035  -14.139725     1 11213 11214
11214 11213  H      7.251534   -9.801317  -13.713884     2 11212
11215 11214  H      6.563758   -9.930227  -15.056360     2 11212
11216 11215  O      6.093038   -1.299187  -31.742393     1 11216 11217
11217 11216  H      5.662936   -1.649008  -30.962093     2 11215
11218 11217  H      6.764693   -1.946593  -31.956813     2 11215
11219 11218  O     -0.581445  -14.803705   -9.839674     1 11219 11220
11220 11219  H     -0.909335  -14.713689  -10.734446     2 11218
11221 11220  H      0.369240  -14.858405   -9.936825     2 11218
11222 11221  O      2.534916   34.101514   -7.394909     1 11222 11223
11223 11222  H      2.686327   33.507543   -6.659719     2 11221
11224 11223  H      2.920705   33.654272   -8.148152     2 11221
11225 11224  O     10.088856   -7.198333   -3.382144     1 11225 11226
11226 11225  H      9.365721   -7.752539   -3.675682     2 11224
11227 11226  H     10.522648   -7.711087   -2.700132     2 11224
11228 11227  O     12.277938  -14.712570  -12.107927     1 11228 11229
11229 11228  H     11.512437  -15.285679  -12.150182     2 11227
11230 11229  H     12.961504  -15.190131  -12.577933     2 11227
11231 11230  O     31.103372   -8.194445   -3.917679     1 11231 11232
11232 11231  H     30.457434   -8.767157   -4.331197     2 11230
11233 11232  H     31.196870   -7.460395   -4.524853     2 11230
11234 11233  O     13.515388  -11.597908   -4.045100     1 11234 11235
11235 11234  H     14.412886  -11.645658   -4.374417     2 11233
11236 11235  H     13.260236  -12.510615   -3.910582     2 11233
11237 11236  O     19.639597  -10.950055   -9.007325     1 11237 11238
11238 11237  H     20.392984  -10.620278   -9.497108     2 11236
11239 11238  H     20.019584  -11.513093   -8.332913     2 11236
11240 11239  O      2.263928  -18.069750   -4.851473     1 11240 11241
11241 11240  H      1.515615  -18.595576   -5.133904     2 11239
11242 11241  H      1.965812  -17.163966   -4.934625     2 11239
11243 11242  O     17.259385   -1.905659   -4.189581     1 11243 11244
11244 11243  H     17.312041   -1.125216   -4.741276     2 11242
11245 11244  H     17.209846   -2.634167   -4.808494     2 11242
11246 11245  O      1.744639   -7.466668   35.161841     1 11246 11247
11247 11246  H      0.913346   -7.082912   35.440973     2 11245
11248 11247  H      1.672347   -8.392022   35.395773     2 11245
11249 11248  O      4.819542  -15.739687  -32.059252     1 11249 11250
11250 11249  H      3.969898  -15.492897  -31.693971     2 11248
11251 11250  H      5.437033  -15.610024  -31.339444     2 11248
11252 11251  O     10.275933   -9.832767  -16.613548     1 11252 11253
11253 11252  H     10.338845   -9.127186  -15.969787     2 11251
11254 11253  H     10.449153  -10.630229  -16.113267     2 11251
11255 11254  O     11.509438   -1.047628  -24.762619     1 11255 11256
11256 11255  H     11.940942   -1.756191  -24.285152     2 11254
11257 11256  H     11.489679   -0.318095  -24.143247     2 11254
11258 11257  O      8.879952   -4.358811  -11.812951     1 11258 11259
11259 11258  H      9.368812   -4.527351  -11.007444     2 11257
11260 11259  H      8.484257   -3.497766  -11.677826     2 11257
11261 11260  O     14.951220   -9.233671  -10.813422     1 11261 11262
11262 11261  H     15.497593   -9.493908  -10.071813     2 11260
11263 11262  H     14.465365   -8.471707  -10.497846     2 11260
11264 11263  O    -15.827011   14.816789   19.912072     1 11264 11265
11265 11264  H    -15.597125   15.248373   20.734945     2 11263
11266 11265  H    -14.985249   14.592507   19.515379     2 11263
11267 11266  O     11.154684    1.424518  -12.814217     1 11267 11268
11268 11267  H     11.135406    1.862692  -11.963416     2 11266
11269 11268  H     10.233328    1.325238  -13.053963     2 11266
11270 11269  O    -30.863747   -0.592200  -11.953557     1 11270 11271
11271 11270  H    -30.426257   -1.149345  -12.597315     2 11269
11272 11271  H    -31.558613   -1.142693  -11.592517     2 11269
11273 11272  O     -5.072944   31.082370   14.393392     1 11273 11274
11274 11273  H     -5.256730   30.386051   13.762841     2 11272
11275 11274  H     -4.169622   30.925046   14.668145     2 11272
11276 11275  O     16.558250  -31.609300   -1.031671     1 11276 11277
11277 11276  H     16.299851  -32.039854   -1.846585     2 11275
11278 11277  H     16.735815  -32.328856   -0.425914     2 11275
11279 11278  O     14.187397  -30.374818    4.165477     1 11279 11280
11280 11279  H     13.831778  -30.464010    5.049678     2 11278
11281 11280  H     14.452620  -29.457091    4.104922     2 11278
11282 11281  O    -27.347295   18.052138    8.748232     1 11282 11283
11283 11282  H    -27.678719   17.395187    9.360446     2 11281
11284 11283  H    -28.020152   18.109033    8.069809     2 11281
11285 11284  O      7.095503   -1.853469  -13.927216     1 11285 11286
11286 11285  H      6.141230   -1.822348  -13.859203     2 11284
11287 11286  H      7.391725   -2.078915  -13.045367     2 11284
11288 11287  O      8.181850   -3.152594  -24.536742     1 11288 11289
11289 11288  H      8.519234   -2.641173  -25.272169     2 11287
11290 11289  H      8.849370   -3.821209  -24.383113     2 11287
11291 11290  O     10.734425   -7.984124   -9.336643     1 11291 11292
11292 11291  H      9.977580   -7.915818   -8.754619     2 11290
11293 11292  H     11.453947   -8.250691   -8.764400     2 11290
11294 11293  O      4.245547  -10.858539  -12.109001     1 11294 11295
11295 11294  H      4.927600  -10.752508  -12.772169     2 11293
11296 11295  H      3.925427  -11.751826  -12.234669     2 11293
11297 11296  O     14.358556  -18.985036  -18.096655     1 11297 11298
11298 11297  H     13.800494  -18.566615  -17.441123     2 11296
11299 11298  H     14.987385  -19.495135  -17.586161     2 11296
11300 11299  O     14.318187  -13.167578  -11.097617     1 11300 11301
11301 11300  H     13.568292  -13.746913  -11.232744     2 11299
11302 11301  H     14.578960  -12.902856  -11.979746     2 11299
11303 11302  O     10.680321  -14.375853  -19.344787     1 11303 11304
11304 11303  H     10.586738  -14.147313  -18.419994     2 11302
11305 11304  H     11.550512  -14.056806  -19.583971     2 11302
11306 11305  O     30.212066   -8.504314   -6.703942     1 11306 11307
11307 11306  H     29.589352   -8.172782   -7.350894     2 11305
11308 11307  H     29.766730   -9.250538   -6.302621     2 11305
11309 11308  O      7.238031   -0.081131   -6.111273     1 11309 11310
11310 11309  H      7.867522   -0.700073   -6.481249     2 11308
11311 11310  H      7.200900    0.632759   -6.747838     2 11308
11312 11311  O     12.905211  -26.423839   -5.978813     1 11312 11313
11313 11312  H     12.844760  -25.562643   -6.392235     2 11311
11314 11313  H     13.812291  -26.694815   -6.120269     2 11311
11315 11314  O     10.021103   -1.199123  -19.403879     1 11315 11316
11316 11315  H      9.421163   -1.930991  -19.547660     2 11314
11317 11316  H     10.384659   -1.013187  -20.269608     2 11314
11318 11317  O     33.866016   -2.395550   -3.032013     1 11318 11319
11319 11318  H     34.724966   -2.594253   -2.659248     2 11317
11320 11319  H     34.019308   -1.639233   -3.598333     2 11317
11321 11320  O     25.489647   -7.629950  -20.353608     1 11321 11322
11322 11321  H     24.861170   -8.331579  -20.523800     2 11320
11323 11322  H     25.042933   -6.833082  -20.639406     2 11320
11324 11323  O      1.599735   -6.314833  -12.175096     1 11324 11325
11325 11324  H      1.772808   -6.559769  -13.084097     2 11323
11326 11325  H      0.807536   -5.779247  -12.217534     2 11323
11327 11326  O     33.881930   -9.147090   -7.135635     1 11327 11328
11328 11327  H     34.075034   -9.638306   -6.337105     2 11326
11329 11328  H     33.611289   -9.813143   -7.767583     2 11326
11330 11329  O     17.724859   -8.024871  -21.724548     1 11330 11331
11331 11330  H     17.981108   -7.118706  -21.552989     2 11329
11332 11331  H     18.324053   -8.548529  -21.192588     2 11329
11333 11332  O      2.001903   31.964029   20.262692     1 11333 11334
11334 11333  H      2.797354   32.496317   20.275296     2 11332
11335 11334  H      1.325469   32.551316   19.925404     2 11332
11336 11335  O     10.395406   -8.750006   -1.200315     1 11336 11337
11337 11336  H     11.174655   -9.177674   -1.555428     2 11335
11338 11337  H      9.828919   -9.471692   -0.927378     2 11335
11339 11338  O     15.011147  -18.656900    2.780943     1 11339 11340
11340 11339  H     15.312856  -19.343468    3.375777     2 11338
11341 11340  H     15.796761  -18.145981    2.585995     2 11338
11342 11341  O     23.351582   -3.379160   -9.276407     1 11342 11343
11343 11342  H     22.950462   -4.241494   -9.384644     2 11341
11344 11343  H     24.090065   -3.379844   -9.885400     2 11341
11345 11344  O     10.858013  -11.985558  -15.180372     1 11345 11346
11346 11345  H     11.471936  -12.659517  -15.472107     2 11344
11347 11346  H     11.197748  -11.702754  -14.331353     2 11344
11348 11347  O     27.277655   -0.186970  -17.563262     1 11348 11349
11349 11348  H     27.894063   -0.303552  -18.286230     2 11347
11350 11349  H     26.861197   -1.042923  -17.462572     2 11347
11351 11350  O     -0.644002  -10.377202  -10.551953     1 11351 11352
11352 11351  H      0.208569   -9.989811  -10.750153     2 11350
11353 11352  H     -1.249475   -9.635838  -10.548395     2 11350
11354 11353  O     13.822721  -14.488700  -22.961546     1 11354 11355
11355 11354  H     14.474404  -14.068162  -23.522518     2 11353
11356 11355  H     13.753413  -15.380856  -23.301378     2 11353
11357 11356  O    -20.144037   29.898050    2.442469     1 11357 11358
11358 11357  H    -21.017121   30.115854    2.768839     2 11356
11359 11358  H    -19.922630   29.075803    2.879642     2 11356
11360 11359  O     20.025596   -1.363488   -1.777346     1 11360 11361
11361 11360  H     19.679665   -1.446877   -2.665946     2 11359
11362 11361  H     19.825424   -2.202414   -1.362178     2 11359
11363 11362  O     24.157316   -9.076175  -10.153911     1 11363 11364
11364 11363  H     24.841026   -9.745883  -10.137703     2 11362
11365 11364  H     23.692105   -9.188039   -9.324877     2 11362
11366 11365  O      8.272185  -29.120959  -16.038241     1 11366 11367
11367 11366  H      7.399286  -28.826285  -16.297947     2 11365
11368 11367  H      8.853491  -28.775725  -16.715830     2 11365
11369 11368  O      1.835479  -14.056100  -36.255819     1 11369 11370
11370 11369  H      0.952536  -14.375548  -36.069820     2 11368
11371 11370  H      2.345277  -14.295398  -35.481820     2 11368
11372 11371  O      9.274434  -13.733641   -8.887421     1 11372 11373
11373 11372  H      9.790164  -12.939684   -8.746405     2 11371
11374 11373  H      8.655834  -13.498326   -9.578936     2 11371
11375 11374  O     13.032332  -13.321982  -20.345632     1 11375 11376
11376 11375  H     13.467468  -13.541068  -21.169580     2 11374
11377 11376  H     13.715864  -13.412737  -19.681721     2 11374
11378 11377  O     14.407945  -12.116772  -17.697644     1 11378 11379
11379 11378  H     14.540985  -11.572194  -16.921778     2 11377
11380 11379  H     13.753394  -12.761454  -17.428983     2 11377
11381 11380  O      9.093647  -12.970307  -17.083486     1 11381 11382
11382 11381  H      8.286081  -12.456441  -17.080107     2 11380
11383 11382  H      9.558331  -12.692258  -16.294190     2 11380
11384 11383  O      6.840522  -16.338570   -2.136280     1 11384 11385
11385 11384  H      7.788682  -16.372962   -2.262933     2 11383
11386 11385  H      6.504500  -15.949538   -2.943730     2 11383
11387 11386  O     -1.025056  -12.466375   -3.486053     1 11387 11388
11388 11387  H     -0.393718  -11.760168   -3.623590     2 11386
11389 11388  H     -0.852739  -13.084098   -4.196656     2 11386
11390 11389  O      3.602707  -13.686299   -6.846383     1 11390 11391
11391 11390  H      3.785231  -14.625713   -6.866829     2 11389
11392 11391  H      2.672076  -13.617944   -7.059653     2 11389
11393 11392  O      8.198255  -10.252745   -9.543635     1 11393 11394
11394 11393  H      9.147135  -10.295237   -9.425086     2 11392
11395 11394  H      7.895578   -9.667804   -8.849040     2 11392
11396 11395  O     25.382688  -16.022481   -3.450058     1 11396 11397
11397 11396  H     26.099695  -16.593749   -3.174767     2 11395
11398 11397  H     25.660207  -15.145092   -3.186610     2 11395
11399 11398  O     17.407725   -4.160990   -5.506633     1 11399 11400
11400 11399  H     17.192459   -5.092991   -5.471044     2 11398
11401 11400  H     17.847974   -4.048368   -6.349087     2 11398
11402 11401  O      9.325434  -21.380445  -15.455147     1 11402 11403
11403 11402  H     10.024548  -20.865382  -15.052428     2 11401
11404 11403  H      8.688194  -20.730281  -15.750855     2 11401
11405 11404  O     23.608106   -2.003750   -7.088149     1 11405 11406
11406 11405  H     24.380307   -2.491927   -6.802459     2 11404
11407 11406  H     23.469674   -2.281989   -7.993495     2 11404
11408 11407  O     14.093382  -16.549260  -12.960821     1 11408 11409
11409 11408  H     14.825180  -17.132951  -13.160842     2 11407
11410 11409  H     13.685319  -16.933250  -12.184762     2 11407
11411 11410  O     12.000311  -14.158954   -4.348556     1 11411 11412
11412 11411  H     12.735315  -14.087663   -4.957586     2 11410
11413 11412  H     12.123388  -15.007027   -3.922111     2 11410
11414 11413  O     22.406043   -5.327848  -14.388686     1 11414 11415
11415 11414  H     23.043667   -5.009279  -15.027576     2 11413
11416 11415  H     21.763426   -4.621912  -14.318475     2 11413
11417 11416  O    -28.925457   -0.039055   22.880731     1 11417 11418
11418 11417  H    -29.230599   -0.499164   23.662664     2 11416
11419 11418  H    -29.604635    0.612180   22.705113     2 11416
11420 11419  O      0.404450  -15.258332  -25.263138     1 11420 11421
11421 11420  H      0.742823  -16.134618  -25.079131     2 11419
11422 11421  H      0.478905  -14.792537  -24.430238     2 11419
11423 11422  O     16.067148   -1.567792   -8.355140     1 11423 11424
11424 11423  H     16.517684   -0.962905   -7.765767     2 11422
11425 11424  H     15.354013   -1.051022   -8.730132     2 11422
11426 11425  O     20.068771  -13.044881   -7.376147     1 11426 11427
11427 11426  H     20.084749  -13.349884   -8.283312     2 11425
11428 11427  H     20.593909  -13.686572   -6.897927     2 11425
11429 11428  O      3.310535   -3.630436  -21.263110     1 11429 11430
11430 11429  H      2.853963   -3.562667  -22.101669     2 11428
11431 11430  H      2.836215   -4.311289  -20.785939     2 11428
11432 11431  O    -19.367495   13.344511   13.542239     1 11432 11433
11433 11432  H    -20.018820   13.792239   13.002287     2 11431
11434 11433  H    -18.958995   12.712418   12.950785     2 11431
11435 11434  O     21.961749    3.361358  -19.615401     1 11435 11436
11436 11435  H     21.600862    2.474898  -19.601952     2 11434
11437 11436  H     22.842090    3.256624  -19.976319     2 11434
11438 11437  O    -24.311344   24.780445    4.889675     1 11438 11439
11439 11438  H    -23.927906   25.279871    4.168717     2 11437
11440 11439  H    -23.585428   24.641075    5.497831     2 11437
11441 11440  O      2.030126  -15.946706  -30.470855     1 11441 11442
11442 11441  H      2.505339  -16.396606  -29.772288     2 11440
11443 11442  H      2.138789  -15.016218  -30.274349     2 11440
11444 11443  O      5.646043    0.392548  -17.139813     1 11444 11445
11445 11444  H      5.187787    0.920625  -16.486079     2 11443
11446 11445  H      5.267029   -0.481872  -17.050541     2 11443
11447 11446  O     31.447077    0.337734   -2.664172     1 11447 11448
11448 11447  H     32.154415    0.892918   -2.992313     2 11446
11449 11448  H     31.328279   -0.326147   -3.343422     2 11446
11450 11449  O     12.778642  -27.310686  -10.227556     1 11450 11451
11451 11450  H     13.624064  -27.610512  -10.561618     2 11449
11452 11451  H     12.273703  -28.113378  -10.097352     2 11449
11453 11452  O     -4.751090  -12.996334  -21.960692     1 11453 11454
11454 11453  H     -4.899403  -12.051121  -21.989083     2 11452
11455 11454  H     -5.157490  -13.278521  -21.141276     2 11452
11456 11455  O     -4.054516   20.223979   27.742023     1 11456 11457
11457 11456  H     -4.830531   20.767698   27.877679     2 11455
11458 11457  H     -3.537359   20.340756   28.538982     2 11455
11459 11458  O      2.471188  -10.396051  -17.107056     1 11459 11460
11460 11459  H      2.367098   -9.569695  -16.635324     2 11458
11461 11460  H      3.415737  -10.550998  -17.114173     2 11458
11462 11461  O     -4.930358  -12.255077  -26.102586     1 11462 11463
11463 11462  H     -5.099676  -11.915746  -26.981459     2 11461
11464 11463  H     -4.036757  -11.974556  -25.905057     2 11461
11465 11464  O     10.638482  -14.974996  -23.355240     1 11465 11466
11466 11465  H     10.763759  -15.103284  -24.295495     2 11464
11467 11466  H     11.255952  -15.581170  -22.945952     2 11464
11468 11467  O      7.481401   -7.238581  -21.536073     1 11468 11469
11469 11468  H      6.711171   -6.695055  -21.702072     2 11467
11470 11469  H      7.210255   -8.121848  -21.786178     2 11467
11471 11470  O    -17.734850   27.176362    7.315555     1 11471 11472
11472 11471  H    -17.033431   26.548828    7.490036     2 11470
11473 11472  H    -17.365623   28.024014    7.563323     2 11470
11474 11473  O      8.681126   -3.652290  -19.197769     1 11474 11475
11475 11474  H      9.102856   -3.938739  -20.007906     2 11473
11476 11475  H      7.774406   -3.475777  -19.448637     2 11473
11477 11476  O    -22.330070   24.481288    6.692444     1 11477 11478
11478 11477  H    -22.489555   24.439444    7.635336     2 11476
11479 11478  H    -21.408126   24.726961    6.615659     2 11476
11480 11479  O     -2.810595   -6.177394  -15.794668     1 11480 11481
11481 11480  H     -1.985156   -6.605897  -15.568246     2 11479
11482 11481  H     -2.927881   -6.359866  -16.726966     2 11479
11483 11482  O     36.075887  -12.424705   -3.458956     1 11483 11484
11484 11483  H     36.532169  -13.064836   -2.912815     2 11482
11485 11484  H     35.154809  -12.513456   -3.214068     2 11482
11486 11485  O      4.930415   -9.947150   -9.377531     1 11486 11487
11487 11486  H      4.240789  -10.217443   -9.983822     2 11485
11488 11487  H      4.607741   -9.130968   -8.995483     2 11485
11489 11488  O      9.583857    0.766627  -24.048005     1 11489 11490
11490 11489  H      9.269704    1.494665  -23.511814     2 11488
11491 11490  H      9.366296   -0.015861  -23.541437     2 11488
11492 11491  O     16.346645  -21.763903   -0.376350     1 11492 11493
11493 11492  H     15.706450  -22.341798   -0.791584     2 11491
11494 11493  H     16.849176  -21.399545   -1.105005     2 11491
11495 11494  O     -6.958524  -12.484545  -23.889318     1 11495 11496
11496 11495  H     -6.643764  -12.264560  -24.766110     2 11494
11497 11496  H     -6.162813  -12.584426  -23.366729     2 11494
11498 11497  O      9.636143   -9.403521  -30.020371     1 11498 11499
11499 11498  H     10.278801  -10.042288  -30.328912     2 11497
11500 11499  H      9.873896   -9.246052  -29.106637     2 11497
11501 11500  O      5.858025  -16.081114  -19.138596     1 11501 11502
11502 11501  H      5.704058  -16.209398  -20.074582     2 11500
11503 11502  H      6.262458  -16.898446  -18.847676     2 11500
11504 11503  O    -17.889231   24.071892   10.173178     1 11504 11505
11505 11504  H    -17.263703   24.796281   10.158774     2 11503
11506 11505  H    -17.352381   23.288776   10.051717     2 11503
11507 11506  O     27.399556   -7.191626  -15.842925     1 11507 11508
11508 11507  H     26.878706   -6.395751  -15.950299     2 11506
11509 11508  H     27.012886   -7.816118  -16.456706     2 11506
11510 11509  O     21.005661  -11.246466   -2.721120     1 11510 11511
11511 11510  H     20.844385  -12.019219   -2.179757     2 11509
11512 11511  H     21.071574  -10.524824   -2.095724     2 11509
11513 11512  O     -4.968531   17.875933   26.819093     1 11513 11514
11514 11513  H     -5.744439   18.309749   26.464124     2 11512
11515 11514  H     -4.470903   18.578603   27.237246     2 11512
11516 11515  O      9.287268  -16.801818  -18.835863     1 11516 11517
11517 11516  H      9.728034  -16.057415  -19.245523     2 11515
11518 11517  H      8.600068  -16.407802  -18.298519     2 11515
11519 11518  O     19.039524  -24.547111   -7.223194     1 11519 11520
11520 11519  H     19.930447  -24.891746   -7.284155     2 11518
11521 11520  H     18.793489  -24.356477   -8.128378     2 11518
11522 11521  O     11.072500   -0.117948  -28.197637     1 11522 11523
11523 11522  H     10.796888   -1.027987  -28.307630     2 11521
11524 11523  H     10.391555    0.393521  -28.634608     2 11521
11525 11524  O      4.973634    0.204170  -10.655073     1 11525 11526
11526 11525  H      5.916227    0.312029  -10.782020     2 11524
11527 11526  H      4.607138    0.237221  -11.538713     2 11524
11528 11527  O     -4.215844    3.597570   -8.964458     1 11528 11529
11529 11528  H     -5.015579    3.613747   -8.438727     2 11527
11530 11529  H     -3.929671    2.684534   -8.937987     2 11527
11531 11530  O      0.442302   30.152786   18.368121     1 11531 11532
11532 11531  H      0.745454   29.636073   17.621570     2 11530
11533 11532  H      1.245146   30.459499   18.789548     2 11530
11534 11533  O      3.960177   -7.831156   -8.120543     1 11534 11535
11535 11534  H      3.287369   -7.477247   -7.538900     2 11533
11536 11535  H      4.767739   -7.397101   -7.845456     2 11533
11537 11536  O     20.903647  -22.773951  -10.810038     1 11537 11538
11538 11537  H     21.529623  -22.855566  -10.090506     2 11536
11539 11538  H     20.179104  -22.268443  -10.441621     2 11536
11540 11539  O     -0.320421    0.920780  -28.353818     1 11540 11541
11541 11540  H     -0.035300    1.575926  -27.716855     2 11539
11542 11541  H     -0.629350    1.431879  -29.101864     2 11539
11543 11542  O      5.016736   -4.712266  -31.860513     1 11543 11544
11544 11543  H      4.094612   -4.689716  -32.116265     2 11542
11545 11544  H      5.005669   -5.000581  -30.947833     2 11542
11546 11545  O     16.163199  -17.176531   -7.408895     1 11546 11547
11547 11546  H     16.251728  -17.647627   -6.580364     2 11545
11548 11547  H     15.418938  -17.593032   -7.843446     2 11545
11549 11548  O      4.105470   -3.252111  -27.720003     1 11549 11550
11550 11549  H      3.244723   -3.588291  -27.470345     2 11548
11551 11550  H      4.666583   -4.027054  -27.749088     2 11548
11552 11551  O    -17.982553   10.379237   15.267215     1 11552 11553
11553 11552  H    -18.176658    9.547673   14.834716     2 11551
11554 11553  H    -17.135909   10.237588   15.690727     2 11551
11555 11554  O      2.873355  -13.576956  -14.984000     1 11555 11556
11556 11555  H      3.757538  -13.326146  -15.251480     2 11554
11557 11556  H      2.912402  -13.611188  -14.028209     2 11554
11558 11557  O     16.809884  -18.611336   -0.248683     1 11558 11559
11559 11558  H     16.665137  -19.247858   -0.948768     2 11557
11560 11559  H     17.017396  -19.142892    0.519833     2 11557
11561 11560  O      9.973661  -14.576966    0.175815     1 11561 11562
11562 11561  H      9.105306  -14.309286    0.476711     2 11560
11563 11562  H     10.132130  -15.413264    0.613678     2 11560
11564 11563  O     28.832886  -10.227060  -10.624408     1 11564 11565
11565 11564  H     29.135924  -10.313785  -11.528221     2 11563
11566 11565  H     28.887282   -9.288973  -10.442020     2 11563
11567 11566  O     21.217591  -17.155702   -7.271393     1 11567 11568
11568 11567  H     21.670585  -17.997197   -7.325372     2 11566
11569 11568  H     20.361064  -17.318459   -7.666494     2 11566
11570 11569  O     13.462506   -6.970313  -24.453167     1 11570 11571
11571 11570  H     14.089336   -6.627651  -25.090269     2 11569
11572 11571  H     13.995288   -7.199551  -23.691705     2 11569
11573 11572  O      0.837775   -5.065023   -5.235321     1 11573 11574
11574 11573  H      1.449706   -5.227537   -5.953208     2 11572
11575 11574  H      1.380278   -4.702485   -4.534972     2 11572
11576 11575  O     -2.548606   28.165317   14.549102     1 11576 11577
11577 11576  H     -3.204757   27.769758   13.975316     2 11575
11578 11577  H     -2.715562   27.777134   15.407981     2 11575
11579 11578  O     -4.977075   15.505811   22.234420     1 11579 11580
11580 11579  H     -5.353814   14.706376   22.602120     2 11578
11581 11580  H     -4.518481   15.914652   22.968432     2 11578
11582 11581  O      8.454444   -5.668639  -16.841432     1 11582 11583
11583 11582  H      8.445026   -5.934234  -17.760998     2 11581
11584 11583  H      8.448694   -4.711823  -16.867918     2 11581
11585 11584  O      3.334816    0.353634  -20.721080     1 11585 11586
11586 11585  H      4.273882    0.528468  -20.782888     2 11584
11587 11586  H      3.276617   -0.487446  -20.267836     2 11584
11588 11587  O      0.551532   -9.866278  -19.420719     1 11588 11589
11589 11588  H      0.900741  -10.274009  -20.213208     2 11587
11590 11589  H      1.195087  -10.070477  -18.742212     2 11587
11591 11590  O      9.086366  -13.138344  -26.281797     1 11591 11592
11592 11591  H      8.902068  -12.329142  -25.804871     2 11590
11593 11592  H      8.641979  -13.028014  -27.122379     2 11590
11594 11593  O     12.141581  -31.540902   -4.182066     1 11594 11595
11595 11594  H     11.297851  -31.090063   -4.215175     2 11593
11596 11595  H     12.659081  -31.132932   -4.876318     2 11593
11597 11596  O     19.373429    3.927660  -25.939682     1 11597 11598
11598 11597  H     19.825586    3.146324  -25.621408     2 11596
11599 11598  H     19.628081    4.618285  -25.327781     2 11596
11600 11599  O      0.275838   -8.451047  -22.651491     1 11600 11601
11601 11600  H     -0.084688   -8.068194  -21.851693     2 11599
11602 11601  H     -0.459498   -8.463628  -23.264154     2 11599
11603 11602  O      6.638802  -11.687852  -17.113194     1 11603 11604
11604 11603  H      5.971617  -11.077395  -16.799447     2 11602
11605 11604  H      6.171013  -12.514511  -17.231690     2 11602
11606 11605  O     10.690506   -7.774366  -24.172992     1 11606 11607
11607 11606  H     11.626565   -7.814569  -23.977013     2 11605
11608 11607  H     10.301886   -7.358171  -23.403584     2 11605
11609 11608  O     11.895803  -23.715225  -12.244013     1 11609 11610
11610 11609  H     12.087171  -23.732409  -11.306296     2 11608
11611 11610  H     11.904967  -24.635338  -12.507718     2 11608
11612 11611  O    -24.547376   18.420540    2.309354     1 11612 11613
11613 11612  H    -25.016601   18.252399    3.126538     2 11611
11614 11613  H    -25.182009   18.217670    1.622101     2 11611
11615 11614  O      2.147168   -3.031862   -1.974119     1 11615 11616
11616 11615  H      2.321948   -2.561729   -2.789385     2 11614
11617 11616  H      2.998434   -3.083168   -1.539439     2 11614
11618 11617  O      8.941255  -35.047692   -2.850696     1 11618 11619
11619 11618  H      9.505288  -35.818369   -2.915155     2 11617
11620 11619  H      9.248866  -34.589927   -2.068354     2 11617
11621 11620  O      4.943614   -0.851502    0.898025     1 11621 11622
11622 11621  H      5.008822   -1.750397    0.575586     2 11620
11623 11622  H      5.560567   -0.357503    0.358058     2 11620
11624 11623  O     -3.183927  -29.624059  -17.471608     1 11624 11625
11625 11624  H     -3.866784  -29.980922  -18.039576     2 11623
11626 11625  H     -3.635798  -28.976198  -16.930942     2 11623
11627 11626  O     -3.769966  -16.743678  -33.156070     1 11627 11628
11628 11627  H     -3.884678  -16.609997  -34.096922     2 11626
11629 11628  H     -3.342860  -17.597376  -33.085285     2 11626
11630 11629  O      7.878016  -11.814494  -30.147481     1 11630 11631
11631 11630  H      7.464090  -10.969331  -30.322401     2 11629
11632 11631  H      8.157540  -12.127453  -31.007803     2 11629
11633 11632  O     -0.442247   -9.042080  -15.715925     1 11633 11634
11634 11633  H     -0.965049   -8.757857  -14.966173     2 11632
11635 11634  H     -1.063024   -9.502453  -16.280659     2 11632
11636 11635  O      7.350744  -26.562017   -4.367239     1 11636 11637
11637 11636  H      7.641331  -25.673505   -4.161483     2 11635
11638 11637  H      7.060546  -26.919936   -3.528246     2 11635
11639 11638  O     14.472377   -4.446927   -5.109650     1 11639 11640
11640 11639  H     13.897498   -3.681759   -5.093411     2 11638
11641 11640  H     13.920338   -5.154846   -5.441819     2 11638
11642 11641  O      4.494596   -5.521492  -29.325238     1 11642 11643
11643 11642  H      5.047476   -5.864350  -28.623095     2 11641
11644 11643  H      3.604857   -5.767142  -29.071757     2 11641
11645 11644  O     11.136863  -11.160929   -5.688667     1 11645 11646
11646 11645  H     10.412282  -11.750910   -5.480973     2 11644
11647 11646  H     11.858505  -11.463841   -5.137569     2 11644
11648 11647  O     12.790328   -4.618256   -8.031069     1 11648 11649
11649 11648  H     12.234297   -4.031609   -8.543813     2 11647
11650 11649  H     13.682608   -4.397691   -8.298309     2 11647
11651 11650  O     13.633703   -7.537778  -16.664842     1 11651 11652
11652 11651  H     12.682250   -7.642192  -16.673064     2 11650
11653 11652  H     13.773821   -6.602762  -16.814317     2 11650
11654 11653  O     21.894664   -5.525494   -9.906409     1 11654 11655
11655 11654  H     21.139797   -5.563971   -9.319105     2 11653
11656 11655  H     21.543682   -5.764336  -10.764312     2 11653
11657 11656  O      6.336424   -9.832804  -31.848913     1 11657 11658
11658 11657  H      6.075662   -9.694762  -32.759506     2 11656
11659 11658  H      7.120941   -9.295343  -31.739825     2 11656
11660 11659  O    -20.081870   13.122697   18.626009     1 11660 11661
11661 11660  H    -19.796750   12.253926   18.342856     2 11659
11662 11661  H    -20.063615   13.652799   17.829209     2 11659
11663 11662  O     33.382970   -1.371324   -9.928836     1 11663 11664
11664 11663  H     34.038854   -2.068491   -9.926635     2 11662
11665 11664  H     32.639578   -1.742695  -10.403897     2 11662
11666 11665  O     17.876514   -9.221991  -11.956799     1 11666 11667
11667 11666  H     17.691987  -10.158862  -11.890063     2 11665
11668 11667  H     17.979169   -9.063863  -12.895249     2 11665
11669 11668  O     -2.221350  -34.396941   17.437224     1 11669 11670
11670 11669  H     -1.708381  -34.565830   18.227522     2 11668
11671 11670  H     -1.583490  -34.071383   16.802103     2 11668
11672 11671  O      4.376110   -8.707415  -24.343629     1 11672 11673
11673 11672  H      5.157453   -8.155416  -24.375735     2 11671
11674 11673  H      4.702370   -9.594258  -24.496262     2 11671
11675 11674  O     -8.292789   32.630757   13.519654     1 11675 11676
11676 11675  H     -7.630160   33.124031   14.003218     2 11674
11677 11676  H     -8.354461   31.794811   13.981848     2 11674
11678 11677  O      7.549779   -2.704282  -28.438586     1 11678 11679
11679 11678  H      7.298677   -3.601693  -28.219878     2 11677
11680 11679  H      7.851159   -2.330793  -27.610391     2 11677
11681 11680  O     11.461186  -16.965201   -5.328856     1 11681 11682
11682 11681  H     11.484519  -17.252622   -4.416126     2 11680
11683 11682  H     10.858731  -16.221376   -5.330902     2 11680
11684 11683  O     15.456188   -3.926856   -2.537569     1 11684 11685
11685 11684  H     15.236536   -3.891749   -3.468565     2 11683
11686 11685  H     16.274694   -4.421889   -2.502607     2 11683
11687 11686  O      5.919980    3.961964  -20.189146     1 11687 11688
11688 11687  H      6.240600    4.470029  -19.443959     2 11686
11689 11688  H      5.001550    4.217171  -20.276253     2 11686
11690 11689  O    -24.694544    7.076074   20.193099     1 11690 11691
11691 11690  H    -25.471096    6.937181   20.735230     2 11689
11692 11691  H    -24.930381    7.804046   19.618061     2 11689
11693 11692  O      2.335947  -11.277315  -25.632960     1 11693 11694
11694 11693  H      2.306246  -11.500430  -24.702600     2 11692
11695 11694  H      2.359137  -12.122438  -26.081803     2 11692
11696 11695  O      5.123858   -6.727226  -34.582170     1 11696 11697
11697 11696  H      4.575643   -5.978627  -34.817313     2 11695
11698 11697  H      4.587718   -7.235548  -33.973571     2 11695
11699 11698  O     16.157978  -12.656295   -4.805489     1 11699 11700
11700 11699  H     17.079776  -12.423960   -4.693508     2 11698
11701 11700  H     16.146718  -13.231700   -5.570351     2 11698
11702 11701  O     11.604602    4.601966   -2.253494     1 11702 11703
11703 11702  H     12.398561    4.884230   -1.799414     2 11701
11704 11703  H     10.902752    5.112171   -1.849354     2 11701
11705 11704  O      5.930153  -18.710580   -5.789731     1 11705 11706
11706 11705  H      5.460312  -18.721466   -4.955847     2 11704
11707 11706  H      5.616568  -17.921495   -6.231592     2 11704
11708 11707  O     18.566818    2.791900  -20.193348     1 11708 11709
11709 11708  H     17.901860    3.181456  -20.761070     2 11707
11710 11709  H     18.282351    3.010084  -19.305820     2 11707
11711 11710  O     28.892544   -8.613848    0.600791     1 11711 11712
11712 11711  H     28.305512   -8.305999   -0.089755     2 11710
11713 11712  H     28.367495   -9.238298    1.101409     2 11710
11714 11713  O     12.221010   -5.732524   -4.073197     1 11714 11715
11715 11714  H     12.332780   -4.954180   -3.527377     2 11713
11716 11715  H     11.421474   -6.143436   -3.744373     2 11713
11717 11716  O      8.105716  -32.556130   -4.097626     1 11717 11718
11718 11717  H      8.423163  -33.322584   -3.620126     2 11716
11719 11718  H      7.345611  -32.259451   -3.597171     2 11716
11720 11719  O      5.647687  -14.303427  -16.987301     1 11720 11721
11721 11720  H      5.413975  -14.834625  -16.226091     2 11719
11722 11721  H      5.599710  -14.909422  -17.726692     2 11719
11723 11722  O      2.122133  -28.464356  -12.054312     1 11723 11724
11724 11723  H      2.562764  -28.799395  -11.273400     2 11722
11725 11724  H      1.579663  -29.193363  -12.355156     2 11722
11726 11725  O     17.207007  -24.764061    1.834753     1 11726 11727
11727 11726  H     17.617780  -25.600025    2.055349     2 11725
11728 11727  H     17.108525  -24.788825    0.882954     2 11725
11729 11728  O     10.637186  -10.621209    2.241403     1 11729 11730
11730 11729  H     10.803726  -10.917471    1.346571     2 11728
11731 11730  H     10.489480  -11.426533    2.737255     2 11728
11732 11731  O      9.607317  -16.464332  -12.804740     1 11732 11733
11733 11732  H      9.514491  -17.352242  -12.459444     2 11731
11734 11733  H      8.708476  -16.163942  -12.939211     2 11731
11735 11734  O      5.938675   -6.526636  -15.748668     1 11735 11736
11736 11735  H      6.803936   -6.456211  -16.151900     2 11734
11737 11736  H      6.072938   -6.249249  -14.842433     2 11734
11738 11737  O      2.993418   -8.999635  -14.718182     1 11738 11739
11739 11738  H      3.799532   -9.477514  -14.913231     2 11737
11740 11739  H      2.550240   -9.535117  -14.060091     2 11737
11741 11740  O      7.287026    7.348390  -29.724877     1 11741 11742
11742 11741  H      8.012335    6.899457  -30.159177     2 11740
11743 11742  H      6.911126    6.688793  -29.141898     2 11740
11744 11743  O    -11.447685   17.424074   19.525433     1 11744 11745
11745 11744  H    -11.149246   16.545717   19.289521     2 11743
11746 11745  H    -12.261727   17.279467   20.007777     2 11743
11747 11746  O     13.202154    0.593706  -19.547457     1 11747 11748
11748 11747  H     13.179172    0.251657  -18.653753     2 11746
11749 11748  H     12.874538    1.489750  -19.469976     2 11746
11750 11749  O     -0.415993  -15.711578  -14.512356     1 11750 11751
11751 11750  H     -0.825518  -14.847693  -14.465199     2 11749
11752 11751  H     -0.877764  -16.157635  -15.222309     2 11749
11753 11752  O      4.919066   -5.727851  -26.497341     1 11753 11754
11754 11753  H      4.483854   -6.541836  -26.750817     2 11752
11755 11754  H      4.459581   -5.446318  -25.706238     2 11752
11756 11755  O      3.998932   -7.896227  -31.106358     1 11756 11757
11757 11756  H      4.408932   -7.519352  -30.327836     2 11755
11758 11757  H      4.644713   -8.519012  -31.440033     2 11755
11759 11758  O      7.827492  -23.031160  -13.888039     1 11759 11760
11760 11759  H      7.977900  -22.638657  -13.028068     2 11758
11761 11760  H      8.399375  -22.541127  -14.478841     2 11758
11762 11761  O     -1.587127  -17.164127   -5.521026     1 11762 11763
11763 11762  H     -1.263668  -17.869903   -6.080923     2 11761
11764 11763  H     -1.356333  -17.437253   -4.633125     2 11761
11765 11764  O      1.089192   35.831224   16.782171     1 11765 11766
11766 11765  H      0.140953   35.733888   16.869348     2 11764
11767 11766  H      1.452552   35.103961   17.287434     2 11764
11768 11767  O     -0.064275   -6.065680  -18.252673     1 11768 11769
11769 11768  H      0.732542   -6.285707  -17.770073     2 11767
11770 11769  H      0.129235   -5.223378  -18.664150     2 11767
11771 11770  O    -25.199915   11.788919   15.570394     1 11771 11772
11772 11771  H    -24.524494   12.147051   16.146398     2 11770
11773 11772  H    -25.129077   10.840455   15.678230     2 11770
11774 11773  O     10.497131    6.804482   -6.165859     1 11774 11775
11775 11774  H     11.247533    7.180507   -5.705713     2 11773
11776 11775  H     10.354622    5.958485   -5.741345     2 11773
11777 11776  O    -21.072420   32.643470    0.677278     1 11777 11778
11778 11777  H    -20.992491   31.893109    0.088380     2 11776
11779 11778  H    -20.454655   32.459955    1.385034     2 11776
11780 11779  O     22.811552   -9.513462  -12.415399     1 11780 11781
11781 11780  H     23.447819   -9.139315  -11.805964     2 11779
11782 11781  H     21.963573   -9.369672  -11.995295     2 11779
11783 11782  O     13.503023   -0.916403   -9.555547     1 11783 11784
11784 11783  H     12.959540   -1.641409   -9.246965     2 11782
11785 11784  H     13.333153   -0.872729  -10.496540     2 11782
11786 11785  O      6.358063    3.365736  -13.799532     1 11786 11787
11787 11786  H      6.964194    3.330991  -14.539551     2 11785
11788 11787  H      5.662015    3.956607  -14.086970     2 11785
11789 11788  O      7.821645    2.236187  -16.970353     1 11789 11790
11790 11789  H      7.249737    1.472057  -16.897829     2 11788
11791 11790  H      8.583286    1.920605  -17.456710     2 11788
11792 11791  O      8.885504  -33.353868   -6.729652     1 11792 11793
11793 11792  H      8.451929  -33.020429   -5.944119     2 11791
11794 11793  H      9.725885  -33.688239   -6.416303     2 11791
11795 11794  O     -2.158890  -10.323146  -13.324114     1 11795 11796
11796 11795  H     -2.474263   -9.420387  -13.281714     2 11794
11797 11796  H     -2.789364  -10.822246  -12.804852     2 11794
11798 11797  O     12.585533   -4.257498   -1.793181     1 11798 11799
11799 11798  H     12.565201   -4.351504   -0.840825     2 11797
11800 11799  H     13.516848   -4.216644   -2.010473     2 11797
11801 11800  O     14.244668  -15.347557    1.822301     1 11801 11802
11802 11801  H     14.404131  -14.585118    1.265982     2 11800
11803 11802  H     14.486986  -16.096702    1.277971     2 11800
11804 11803  O     11.226699  -15.729632   -8.570791     1 11804 11805
11805 11804  H     11.098893  -15.768492   -7.622958     2 11803
11806 11805  H     10.683903  -14.994689   -8.856209     2 11803
11807 11806  O     20.555701  -12.295169  -17.899153     1 11807 11808
11808 11807  H     19.726122  -11.981253  -18.258998     2 11806
11809 11808  H     20.535580  -12.027049  -16.980492     2 11806
11810 11809  O     18.208114  -15.646452  -14.369581     1 11810 11811
11811 11810  H     18.686548  -15.103448  -14.996063     2 11809
11812 11811  H     17.549586  -16.098166  -14.897337     2 11809
11813 11812  O     11.380000  -27.436041   -4.157578     1 11813 11814
11814 11813  H     10.607755  -27.774194   -4.610926     2 11812
11815 11814  H     11.983591  -27.193661   -4.859833     2 11812
11816 11815  O     21.729241  -14.843369   -6.059794     1 11816 11817
11817 11816  H     21.663041  -15.661406   -6.552405     2 11815
11818 11817  H     21.103492  -14.943885   -5.342462     2 11815
11819 11818  O     15.369136    1.399394   -8.339800     1 11819 11820
11820 11819  H     14.635430    0.939709   -8.747961     2 11818
11821 11820  H     15.438635    2.220549   -8.826737     2 11818
11822 11821  O      7.458957   -2.076186  -11.101222     1 11822 11823
11823 11822  H      7.802783   -1.197911  -10.937981     2 11821
11824 11823  H      6.775635   -2.192916  -10.441165     2 11821
11825 11824  O     30.829636  -12.022478   -9.584878     1 11825 11826
11826 11825  H     30.087675  -11.533990   -9.941394     2 11824
11827 11826  H     31.414983  -12.148682  -10.331653     2 11824
11828 11827  O      8.773591  -17.584924    0.430512     1 11828 11829
11829 11828  H      9.724341  -17.487805    0.484128     2 11827
11830 11829  H      8.640141  -18.300931   -0.190581     2 11827
11831 11830  O      6.522808  -26.643981    3.413008     1 11831 11832
11832 11831  H      6.578499  -27.549678    3.108306     2 11830
11833 11832  H      7.039398  -26.145556    2.779810     2 11830
11834 11833  O     24.263271  -13.200044   -4.194423     1 11834 11835
11835 11834  H     23.942158  -12.385394   -4.581029     2 11833
11836 11835  H     23.471038  -13.676836   -3.946900     2 11833
11837 11836  O     26.914994   -4.072167  -13.633909     1 11837 11838
11838 11837  H     27.260406   -4.196544  -14.517908     2 11836
11839 11838  H     27.363190   -3.291372  -13.308778     2 11836
11840 11839  O      7.864339  -16.089403  -16.784131     1 11840 11841
11841 11840  H      7.194424  -15.405917  -16.767014     2 11839
11842 11841  H      7.504069  -16.792162  -16.243237     2 11839
11843 11842  O      2.588592   -0.478176  -24.764290     1 11843 11844
11844 11843  H      2.010580    0.004967  -24.173775     2 11842
11845 11844  H      2.210992   -1.356853  -24.803995     2 11842
11846 11845  O    -26.208903    2.917317   22.742203     1 11846 11847
11847 11846  H    -26.295356    2.042705   23.121426     2 11845
11848 11847  H    -25.451591    2.852824   22.160352     2 11845
11849 11848  O      8.030146  -15.429556  -22.119297     1 11849 11850
11850 11849  H      7.908730  -14.877731  -21.346652     2 11848
11851 11850  H      8.921705  -15.240237  -22.411719     2 11848
11852 11851  O      6.829190   -6.748131  -18.924192     1 11852 11853
11853 11852  H      7.179514   -7.570713  -18.582338     2 11851
11854 11853  H      6.795589   -6.877104  -19.872068     2 11851
11855 11854  O     -5.256561   -9.407794  -17.001396     1 11855 11856
11856 11855  H     -5.349594  -10.174262  -17.567174     2 11854
11857 11856  H     -5.683188   -9.660646  -16.182685     2 11854
11858 11857  O    -22.531147    8.332437   22.525246     1 11858 11859
11859 11858  H    -22.241054    8.055424   23.394349     2 11857
11860 11859  H    -22.753215    7.517318   22.075248     2 11857
11861 11860  O     13.379140  -31.922373   -6.639066     1 11861 11862
11862 11861  H     13.976516  -31.435143   -7.206498     2 11860
11863 11862  H     13.598504  -32.841392   -6.792414     2 11860
11864 11863  O     25.182368  -19.596413   -2.486669     1 11864 11865
11865 11864  H     24.492891  -19.078075   -2.901614     2 11863
11866 11865  H     25.889090  -19.616100   -3.131951     2 11863
11867 11866  O     11.325367  -11.937026  -12.483286     1 11867 11868
11868 11867  H     11.708341  -12.810662  -12.562805     2 11866
11869 11868  H     10.742491  -11.998481  -11.726510     2 11866
11870 11869  O     19.372359  -21.661060   -6.663556     1 11870 11871
11871 11870  H     18.485315  -21.323999   -6.789153     2 11869
11872 11871  H     19.410883  -22.445234   -7.211114     2 11869
11873 11872  O     22.702960  -22.727092    6.156642     1 11873 11874
11874 11873  H     22.114576  -22.928467    5.428986     2 11872
11875 11874  H     23.569061  -22.662752    5.754199     2 11872
11876 11875  O      5.023125   -1.071548   -8.131376     1 11876 11877
11877 11876  H      4.769954   -0.618457   -8.935642     2 11875
11878 11877  H      5.936750   -0.821950   -7.992736     2 11875
11879 11878  O     14.635692  -10.331838   -6.704701     1 11879 11880
11880 11879  H     14.055321  -10.585075   -7.422526     2 11878
11881 11880  H     14.341259   -9.455743   -6.455704     2 11878
11882 11881  O     20.007103  -14.696576   -3.903387     1 11882 11883
11883 11882  H     20.000392  -14.328781   -3.019694     2 11881
11884 11883  H     19.613986  -15.563804   -3.805381     2 11881
11885 11884  O      5.757197    1.686325   -1.076863     1 11885 11886
11886 11885  H      6.209052    2.470665   -0.765627     2 11884
11887 11886  H      4.827034    1.897864   -0.997617     2 11884
11888 11887  O      8.511182  -25.267312   -9.246535     1 11888 11889
11889 11888  H      8.733498  -26.149445   -8.948795     2 11887
11890 11889  H      8.904764  -25.201371  -10.116580     2 11887
11891 11890  O    -19.370445   10.492615   23.969992     1 11891 11892
11892 11891  H    -18.743591   10.148810   24.606454     2 11890
11893 11892  H    -19.099664   11.400399   23.832741     2 11890
11894 11893  O     -3.400869   26.695211   23.150153     1 11894 11895
11895 11894  H     -3.441949   27.553539   22.728469     2 11893
11896 11895  H     -2.763933   26.203410   22.631814     2 11893
11897 11896  O     29.259269   -2.145385   -7.218443     1 11897 11898
11898 11897  H     28.477670   -2.401756   -7.707941     2 11896
11899 11898  H     29.822945   -1.726270   -7.868707     2 11896
11900 11899  O     19.833825  -19.482758  -10.264329     1 11900 11901
11901 11900  H     19.438101  -18.736260   -9.814467     2 11899
11902 11901  H     20.773205  -19.299257  -10.253132     2 11899
11903 11902  O     10.521402    4.540991   -4.792233     1 11903 11904
11904 11903  H     10.848400    4.616918   -3.895830     2 11902
11905 11904  H      9.929043    3.789465   -4.768756     2 11902
11906 11905  O     19.779040  -11.319716  -15.305893     1 11906 11907
11907 11906  H     18.897578  -11.188649  -14.956496     2 11905
11908 11907  H     20.306704  -10.639587  -14.887291     2 11905
11909 11908  O     29.111570   -6.317643   -8.537450     1 11909 11910
11910 11909  H     29.353369   -5.405275   -8.696666     2 11908
11911 11910  H     29.726357   -6.824862   -9.067541     2 11908
11912 11911  O     11.271584  -33.860976   -5.467888     1 11912 11913
11913 11912  H     11.727380  -33.119450   -5.069613     2 11911
11914 11913  H     11.972106  -34.439422   -5.769385     2 11911
11915 11914  O    -24.183174    2.687131   20.910851     1 11915 11916
11916 11915  H    -23.458141    3.025370   20.385349     2 11914
11917 11916  H    -24.123764    1.736304   20.817956     2 11914
11918 11917  O      1.232115  -29.903154  -21.119670     1 11918 11919
11919 11918  H      1.355228  -30.365386  -21.948776     2 11917
11920 11919  H      1.695322  -30.438470  -20.475382     2 11917
11921 11920  O      8.213975   -2.780745   -7.779969     1 11921 11922
11922 11921  H      8.740349   -3.270077   -7.147738     2 11920
11923 11922  H      7.844337   -3.451213   -8.354488     2 11920
11924 11923  O     31.059968    2.265383  -11.730136     1 11924 11925
11925 11924  H     31.800831    2.040279  -11.167391     2 11923
11926 11925  H     31.458342    2.668167  -12.501690     2 11923
11927 11926  O     15.490142  -24.394588  -10.301653     1 11927 11928
11928 11927  H     14.553138  -24.546900  -10.178948     2 11926
11929 11928  H     15.700927  -24.842929  -11.120672     2 11926
11930 11929  O      9.036632  -12.945436   -4.540765     1 11930 11931
11931 11930  H      8.642214  -12.156338   -4.169295     2 11929
11932 11931  H      9.180965  -13.518779   -3.787985     2 11929
11933 11932  O     23.242493   -8.954331  -17.682944     1 11933 11934
11934 11933  H     23.056650   -9.891310  -17.744286     2 11932
11935 11934  H     23.029675   -8.726198  -16.778015     2 11932
11936 11935  O     25.904424  -22.601742   -1.198562     1 11936 11937
11937 11936  H     25.621905  -22.599346   -2.113116     2 11935
11938 11937  H     26.858495  -22.665530   -1.242278     2 11935
11939 11938  O      1.582264  -13.661570  -32.997793     1 11939 11940
11940 11939  H      1.417357  -14.578228  -33.218646     2 11938
11941 11940  H      1.077108  -13.512667  -32.198495     2 11938
11942 11941  O     -0.095173   -6.599258   -8.694391     1 11942 11943
11943 11942  H      0.254902   -7.194033   -8.031125     2 11941
11944 11943  H      0.447138   -6.755899   -9.467433     2 11941
11945 11944  O      2.310212  -14.451454  -19.546788     1 11945 11946
11946 11945  H      2.267153  -14.791687  -18.653133     2 11944
11947 11946  H      3.233944  -14.237532  -19.677888     2 11944
11948 11947  O     14.814087  -15.901208   -4.208844     1 11948 11949
11949 11948  H     14.872394  -15.971495   -5.161677     2 11947
11950 11949  H     14.661994  -16.798054   -3.910907     2 11947
11951 11950  O      9.789115   -3.990011   -2.929724     1 11951 11952
11952 11951  H     10.518312   -3.951826   -2.310818     2 11950
11953 11952  H      9.608011   -4.924573   -3.029852     2 11950
11954 11953  O    -32.936104   -1.893476  -18.448027     1 11954 11955
11955 11954  H    -32.053772   -1.523276  -18.422057     2 11953
11956 11955  H    -32.801447   -2.839203  -18.387220     2 11953
11957 11956  O      5.734940  -18.886194  -18.539001     1 11957 11958
11958 11957  H      6.146057  -19.688781  -18.217956     2 11956
11959 11958  H      4.916536  -18.822267  -18.046701     2 11956
11960 11959  O     15.738952    3.261767  -10.308444     1 11960 11961
11961 11960  H     16.689267    3.296940  -10.199372     2 11959
11962 11961  H     15.607858    3.208317  -11.255117     2 11959
11963 11962  O     -1.840946  -12.894461  -22.641718     1 11963 11964
11964 11963  H     -1.491927  -13.596828  -22.092994     2 11962
11965 11964  H     -2.787102  -12.927223  -22.500482     2 11962
11966 11965  O      5.792243  -14.780672   -4.177284     1 11966 11967
11967 11966  H      5.405299  -13.974043   -3.836909     2 11965
11968 11967  H      6.296760  -14.501096   -4.941177     2 11965
11969 11968  O     17.076155  -10.761839  -14.962381     1 11969 11970
11970 11969  H     16.232058  -10.810206  -15.411149     2 11968
11971 11970  H     17.404787   -9.885510  -15.163080     2 11968
11972 11971  O      5.947411  -22.963947    1.857349     1 11972 11973
11973 11972  H      5.630404  -23.861144    1.753548     2 11971
11974 11973  H      6.150942  -22.676838    0.967194     2 11971
11975 11974  O      1.798644   -7.008635  -25.205048     1 11975 11976
11976 11975  H      1.186240   -7.644698  -25.574665     2 11974
11977 11976  H      2.420257   -7.536943  -24.704329     2 11974
11978 11977  O      8.627385    0.669818  -13.469141     1 11978 11979
11979 11978  H      8.122126    1.472932  -13.342845     2 11977
11980 11979  H      7.974793    0.010185  -13.704174     2 11977
11981 11980  O     10.722355  -27.403145   -7.754425     1 11981 11982
11982 11981  H     10.901123  -28.255642   -8.151317     2 11980
11983 11982  H     11.572890  -27.105733   -7.431365     2 11980
11984 11983  O      7.534397    0.754761  -10.377344     1 11984 11985
11985 11984  H      7.549320    0.981486   -9.447503     2 11983
11986 11985  H      7.488894    1.597408  -10.829126     2 11983
11987 11986  O      3.741572  -31.807816   -6.119872     1 11987 11988
11988 11987  H      3.409920  -31.876699   -5.224610     2 11986
11989 11988  H      2.956873  -31.713934   -6.659933     2 11986
11990 11989  O     22.645768   -2.603249   14.527383     1 11990 11991
11991 11990  H     23.159072   -3.129934   13.914722     2 11989
11992 11991  H     23.293953   -2.068205   14.985438     2 11989
11993 11992  O     -1.312428  -12.470794    1.098644     1 11993 11994
11994 11993  H     -1.790335  -12.191088    0.317874     2 11992
11995 11994  H     -1.920032  -12.313102    1.821266     2 11992
11996 11995  O      7.626352    0.842519    5.319167     1 11996 11997
11997 11996  H      7.348988   -0.023707    5.020918     2 11995
11998 11997  H      8.276474    1.121540    4.674403     2 11995
11999 11998  O     12.115615  -13.007000   21.254538     1 11999 12000
12000 11999  H     12.014157  -12.141841   20.857752     2 11998
12001 12000  H     11.925970  -12.869132   22.182578     2 11998
12002 12001  O     20.691220  -14.061971    8.816964     1 12002 12003
12003 12002  H     21.250331  -13.356353    9.142123     2 12001
12004 12003  H     19.853642  -13.928292    9.260614     2 12001
12005 12004  O     16.954050  -20.396445   13.569343     1 12005 12006
12006 12005  H     16.316897  -20.057426   12.940587     2 12004
12007 12006  H     16.422343  -20.763252   14.275722     2 12004
12008 12007  O     20.040177   -4.091850    7.068696     1 12008 12009
12009 12008  H     20.123708   -4.636852    7.851146     2 12007
12010 12009  H     20.137384   -3.195188    7.389288     2 12007
12011 12010  O     11.198903  -25.305577    2.826122     1 12011 12012
12012 12011  H     10.652083  -25.547120    3.573702     2 12010
12013 12012  H     12.061231  -25.665763    3.033219     2 12010
12014 12013  O      0.312437   -2.529757   24.106822     1 12014 12015
12015 12014  H     -0.146118   -2.353391   23.285327     2 12013
12016 12015  H      1.025125   -3.119955   23.861926     2 12013
12017 12016  O     22.468930  -22.860222   -1.026206     1 12017 12018
12018 12017  H     21.766473  -22.577250   -0.440789     2 12016
12019 12018  H     22.200568  -22.549414   -1.890852     2 12016
12020 12019  O     14.367984   -8.506975   29.081648     1 12020 12021
12021 12020  H     14.861726   -8.120343   29.804813     2 12019
12022 12021  H     13.521819   -8.059994   29.102740     2 12019
12023 12022  O      1.574298   -0.799751    8.552384     1 12023 12024
12024 12023  H      2.100958   -0.000464    8.553649     2 12022
12025 12024  H      1.996956   -1.364623    7.905459     2 12022
12026 12025  O     15.905538   -7.800324    2.652351     1 12026 12027
12027 12026  H     14.962859   -7.932725    2.752640     2 12025
12028 12027  H     16.061892   -6.919884    2.993832     2 12025
12029 12028  O     -3.912379   32.242994  -14.742760     1 12029 12030
12030 12029  H     -4.614929   31.625476  -14.539467     2 12028
12031 12030  H     -4.146877   32.599740  -15.599483     2 12028
12032 12031  O    -11.018035    9.938670  -30.742576     1 12032 12033
12033 12032  H    -11.123778    9.076782  -31.145313     2 12031
12034 12033  H    -11.099454   10.555202  -31.470237     2 12031
12035 12034  O    -26.219445   17.891904   -8.863106     1 12035 12036
12036 12035  H    -25.769289   17.376342   -9.532276     2 12034
12037 12036  H    -27.069786   17.464138   -8.762278     2 12034
12038 12037  O      2.516885  -13.978652   22.890220     1 12038 12039
12039 12038  H      2.350134  -14.237645   23.796503     2 12037
12040 12039  H      2.945500  -14.739463   22.498191     2 12037
12041 12040  O     13.045559  -29.693661   10.923210     1 12041 12042
12042 12041  H     13.524030  -29.680162   11.752134     2 12040
12043 12042  H     13.639088  -30.127961   10.310561     2 12040
12044 12043  O      6.545580  -29.477155   18.285610     1 12044 12045
12045 12044  H      6.374384  -29.505163   19.226960     2 12043
12046 12045  H      5.983404  -28.774062   17.960263     2 12043
12047 12046  O      9.432147  -11.796523   32.937658     1 12047 12048
12048 12047  H      9.411559  -11.285409   32.128603     2 12046
12049 12048  H      9.021705  -12.629583   32.705755     2 12046
12050 12049  O     -0.234345  -26.476660    6.706829     1 12050 12051
12051 12050  H     -0.105224  -25.563591    6.450186     2 12049
12052 12051  H     -0.499727  -26.432515    7.625446     2 12049
12053 12052  O    -23.500307   -0.427139  -24.914084     1 12053 12054
12054 12053  H    -23.294704   -1.332469  -24.680981     2 12052
12055 12054  H    -24.183687   -0.169306  -24.295421     2 12052
12056 12055  O    -23.945262   16.612643   -0.088069     1 12056 12057
12057 12056  H    -23.480348   17.259774    0.442315     2 12055
12058 12057  H    -23.292156   16.302643   -0.715432     2 12055
12059 12058  O     10.027880  -20.485394   12.629633     1 12059 12060
12060 12059  H     10.126162  -19.699800   12.091662     2 12058
12061 12060  H      9.589733  -21.115054   12.057106     2 12058
12062 12061  O     -0.623876   -2.619882   20.588507     1 12062 12063
12063 12062  H     -0.687191   -2.640895   19.633635     2 12061
12064 12063  H      0.219062   -3.029963   20.782210     2 12061
12065 12064  O     29.948593  -17.114247    0.235355     1 12065 12066
12066 12065  H     29.682917  -17.372081    1.118061     2 12064
12067 12066  H     29.569916  -16.243342    0.115527     2 12064
12068 12067  O      5.977348  -20.698846    9.336787     1 12068 12069
12069 12068  H      5.163347  -20.210974    9.461753     2 12067
12070 12069  H      5.995967  -20.898914    8.400914     2 12067
12071 12070  O      9.715994   -5.895720    5.743095     1 12071 12072
12072 12071  H      9.786934   -5.005124    6.086660     2 12070
12073 12072  H      9.544838   -5.779492    4.808522     2 12070
12074 12073  O      5.118882   -0.739207   14.864703     1 12074 12075
12075 12074  H      5.449322   -1.294497   14.158520     2 12073
12076 12075  H      5.793895   -0.784961   15.541826     2 12073
12077 12076  O     24.845217   -4.747242   17.657100     1 12077 12078
12078 12077  H     25.486267   -4.421642   17.025220     2 12076
12079 12078  H     25.336783   -5.360699   18.203236     2 12076
12080 12079  O     17.182148  -13.486909    1.271513     1 12080 12081
12081 12080  H     16.710519  -13.562336    2.101036     2 12079
12082 12081  H     16.541240  -13.118020    0.663739     2 12079
12083 12082  O      5.923409   -9.941836    9.431795     1 12083 12084
12084 12083  H      5.268405  -10.263412    8.812287     2 12082
12085 12084  H      6.000481   -9.007975    9.236360     2 12082
12086 12085  O    -11.054397   20.757349  -21.071210     1 12086 12087
12087 12086  H    -11.495962   21.192071  -21.800777     2 12085
12088 12087  H    -10.253257   20.399951  -21.454190     2 12085
12089 12088  O      4.068723  -17.520217   15.281457     1 12089 12090
12090 12089  H      4.924753  -17.944440   15.222477     2 12088
12091 12090  H      3.959301  -17.082174   14.437432     2 12088
12092 12091  O     32.042143   -2.238597   13.509259     1 12092 12093
12093 12092  H     31.329540   -1.734240   13.116763     2 12091
12094 12093  H     31.604270   -2.954830   13.969159     2 12091
12095 12094  O      3.763984  -34.056601    5.850184     1 12095 12096
12096 12095  H      4.004548  -33.171296    6.123305     2 12094
12097 12096  H      4.596495  -34.526054    5.797542     2 12094
12098 12097  O      6.507302  -10.733949   24.728330     1 12098 12099
12099 12098  H      6.979202   -9.982087   25.086441     2 12097
12100 12099  H      5.592347  -10.453754   24.704267     2 12097
12101 12100  O      2.657937  -12.485854   32.171172     1 12101 12102
12102 12101  H      2.079479  -13.163572   32.520909     2 12100
12103 12102  H      3.400155  -12.968312   31.807059     2 12100
12104 12103  O      2.468194   -0.090872  -36.034671     1 12104 12105
12105 12104  H      2.496123    0.772642  -36.446734     2 12103
12106 12105  H      1.718046   -0.049595  -35.441539     2 12103
12107 12106  O     -6.653337  -16.489463    3.565724     1 12107 12108
12108 12107  H     -7.104519  -16.735126    2.758063     2 12106
12109 12108  H     -6.201843  -15.673534    3.349751     2 12106
12110 12109  O      0.734484  -18.835231   17.059078     1 12110 12111
12111 12110  H      0.376294  -19.399067   17.744658     2 12109
12112 12111  H      1.425861  -19.359110   16.654380     2 12109
12113 12112  O      2.346236   -7.716139   -1.737810     1 12113 12114
12114 12113  H      2.710600   -7.075949   -2.349061     2 12112
12115 12114  H      1.635734   -7.249947   -1.297262     2 12112
12116 12115  O     10.762556  -28.882789   12.180144     1 12116 12117
12117 12116  H     10.833583  -27.928530   12.156129     2 12115
12118 12117  H     11.492906  -29.191374   11.643866     2 12115
12119 12118  O    -13.439934   20.009660  -19.706160     1 12119 12120
12120 12119  H    -13.422103   19.057587  -19.608844     2 12118
12121 12120  H    -12.629636   20.218611  -20.170905     2 12118
12122 12121  O      4.227176  -10.175595   28.953581     1 12122 12123
12123 12122  H      3.318052  -10.263174   29.240037     2 12121
12124 12123  H      4.381322  -10.945131   28.405599     2 12121
12125 12124  O     17.518879  -17.692521    3.407625     1 12125 12126
12126 12125  H     18.201154  -17.906929    2.771417     2 12124
12127 12126  H     17.744048  -18.206214    4.183286     2 12124
12128 12127  O      9.706383   -7.848828    2.732024     1 12128 12129
12129 12128  H     10.206281   -8.665098    2.725869     2 12127
12130 12129  H     10.257275   -7.233681    3.216116     2 12127
12131 12130  O     10.041829   -3.989795   33.439529     1 12131 12132
12132 12131  H     10.595899   -4.068988   34.216038     2 12130
12133 12132  H     10.508803   -4.477116   32.760792     2 12130
12134 12133  O     -1.064154  -26.439209    9.290573     1 12134 12135
12135 12134  H     -1.873347  -26.741672    8.878319     2 12133
12136 12135  H     -1.291151  -26.331305   10.214186     2 12133
12137 12136  O     17.169244  -25.916725    5.907070     1 12137 12138
12138 12137  H     17.633499  -26.412863    6.581271     2 12136
12139 12138  H     16.614259  -25.308945    6.395770     2 12136
12140 12139  O     14.423407   -7.710759   20.208543     1 12140 12141
12141 12140  H     13.661021   -7.420514   19.707786     2 12139
12142 12141  H     15.090573   -7.046233   20.036710     2 12139
12143 12142  O     12.460453  -20.345547    5.692384     1 12143 12144
12144 12143  H     12.445013  -19.497680    6.136360     2 12142
12145 12144  H     13.226127  -20.302583    5.119558     2 12142
12146 12145  O     12.245638  -33.759673    3.246941     1 12146 12147
12147 12146  H     11.384091  -33.856258    2.841184     2 12145
12148 12147  H     12.854854  -34.128366    2.607290     2 12145
12149 12148  O     24.500390  -15.103729   10.528133     1 12149 12150
12150 12149  H     23.793083  -15.738138   10.412067     2 12148
12151 12150  H     24.629171  -14.726035    9.658079     2 12148
12152 12151  O      8.428543   -2.777701   19.503032     1 12152 12153
12153 12152  H      8.038410   -2.124197   20.083514     2 12151
12154 12153  H      9.297052   -2.938416   19.871942     2 12151
12155 12154  O     20.358641  -21.584964    7.525769     1 12155 12156
12156 12155  H     21.103405  -21.942507    7.042320     2 12154
12157 12156  H     19.625648  -22.154972    7.293296     2 12154
12158 12157  O      4.065380   -8.759154    1.200396     1 12158 12159
12159 12158  H      4.240223   -8.114111    1.885656     2 12157
12160 12159  H      3.271742   -8.442146    0.769263     2 12157
12161 12160  O     18.477070   -6.280213   17.706618     1 12161 12162
12162 12161  H     19.290469   -5.878473   17.401300     2 12160
12163 12162  H     18.746794   -7.125887   18.064828     2 12160
12164 12163  O     35.638946   -4.869505    9.603614     1 12164 12165
12165 12164  H     34.977112   -5.481754    9.282119     2 12163
12166 12165  H     36.427968   -5.401483    9.706935     2 12163
12167 12166  O      2.853986  -30.321913    7.431007     1 12167 12168
12168 12167  H      3.763626  -30.508275    7.198505     2 12166
12169 12168  H      2.751538  -29.384483    7.266809     2 12166
12170 12169  O      0.840078   -3.502419   33.070694     1 12170 12171
12171 12170  H      1.467537   -4.212502   32.935381     2 12169
12172 12171  H      1.139310   -3.066555   33.868639     2 12169
12173 12172  O      4.281012  -22.773054   12.288898     1 12173 12174
12174 12173  H      4.033104  -23.064555   11.411515     2 12172
12175 12174  H      4.315181  -23.576537   12.808011     2 12172
12176 12175  O     24.195543    1.913204   11.556165     1 12176 12177
12177 12176  H     23.791537    1.947427   12.423252     2 12175
12178 12177  H     23.467012    1.745377   10.958413     2 12175
12179 12178  O      6.979176   -1.945241   32.243307     1 12179 12180
12180 12179  H      6.864113   -2.009570   33.191386     2 12178
12181 12180  H      6.164565   -1.553206   31.928746     2 12178
12182 12181  O     16.883554   -6.394800   25.749316     1 12182 12183
12183 12182  H     17.501970   -6.596902   26.451417     2 12181
12184 12183  H     17.341865   -5.757121   25.202005     2 12181
12185 12184  O     -6.245417   11.084291  -25.090920     1 12185 12186
12186 12185  H     -6.835642   10.820175  -25.796689     2 12184
12187 12186  H     -6.171556   12.034214  -25.182690     2 12184
12188 12187  O     19.904317   -6.001611    8.956020     1 12188 12189
12189 12188  H     20.649072   -6.164256    9.534915     2 12187
12190 12189  H     19.810776   -6.810199    8.452366     2 12187
12191 12190  O      3.822156   34.853357   13.035089     1 12191 12192
12192 12191  H      4.015898   35.778254   12.882576     2 12190
12193 12192  H      4.399656   34.602927   13.756206     2 12190
12194 12193  O     15.343716   -5.904335    9.530825     1 12194 12195
12195 12194  H     15.281715   -6.502197   10.275774     2 12193
12196 12195  H     15.817129   -5.145184    9.871121     2 12193
12197 12196  O      8.873597  -26.155087    4.913951     1 12197 12198
12198 12197  H      8.009418  -25.868251    4.618740     2 12196
12199 12198  H      8.696998  -26.909396    5.476147     2 12196
12200 12199  O    -30.156811   12.082861  -10.340212     1 12200 12201
12201 12200  H    -29.589241   12.417007  -11.034792     2 12199
12202 12201  H    -30.984983   11.889216  -10.779376     2 12199
12203 12202  O      8.415229    2.043037   14.208588     1 12203 12204
12204 12203  H      9.067083    1.985730   14.907182     2 12202
12205 12204  H      7.641512    2.414715   14.632202     2 12202
12206 12205  O     12.299366  -14.509025    3.872797     1 12206 12207
12207 12206  H     12.671953  -13.948708    3.192021     2 12205
12208 12207  H     12.495896  -14.054455    4.691926     2 12205
12209 12208  O     19.979557   -1.899653   13.737507     1 12209 12210
12210 12209  H     20.709089   -2.252442   14.246973     2 12208
12211 12210  H     19.208282   -2.354166   14.076305     2 12208
12212 12211  O     10.321186  -20.549149    3.333690     1 12212 12213
12213 12212  H     10.428544  -21.194656    2.635101     2 12211
12214 12213  H     10.994149  -20.775941    3.975497     2 12211
12215 12214  O      2.461604   -8.254747    3.738252     1 12215 12216
12216 12215  H      1.994076   -7.624179    3.190499     2 12214
12217 12216  H      1.981607   -8.255549    4.566403     2 12214
12218 12217  O    -11.395288   30.105066   -6.321526     1 12218 12219
12219 12218  H    -10.536649   30.330942   -5.963826     2 12217
12220 12219  H    -11.280394   29.227095   -6.685116     2 12217
12221 12220  O    -10.916898   17.662719  -20.225103     1 12221 12222
12222 12221  H    -10.091027   17.814828  -19.765720     2 12220
12223 12222  H    -10.662789   17.222655  -21.036277     2 12220
12224 12223  O     20.582712  -24.096466    3.696381     1 12224 12225
12225 12224  H     21.197942  -24.769169    3.988263     2 12223
12226 12225  H     20.990047  -23.721187    2.915692     2 12223
12227 12226  O     28.968042    0.829821   15.858367     1 12227 12228
12228 12227  H     29.920618    0.736005   15.853032     2 12226
12229 12228  H     28.747025    0.982019   16.777180     2 12226
12230 12229  O      3.207901  -20.647582   20.821713     1 12230 12231
12231 12230  H      3.650818  -19.807486   20.941276     2 12229
12232 12231  H      3.284796  -20.828229   19.884865     2 12229
12233 12232  O     14.307835  -18.357402   16.481707     1 12233 12234
12234 12233  H     14.316159  -19.170696   15.977013     2 12232
12235 12234  H     13.382525  -18.118688   16.536926     2 12232
12236 12235  O     14.955589  -33.094971    5.470947     1 12236 12237
12237 12236  H     14.413889  -33.796954    5.831520     2 12235
12238 12237  H     14.735799  -33.076562    4.539505     2 12235
12239 12238  O     11.668779  -31.819111    4.884278     1 12239 12240
12240 12239  H     12.001785  -32.381843    4.185228     2 12238
12241 12240  H     11.433174  -32.424079    5.587652     2 12238
12242 12241  O      9.940157  -35.897636    4.596475     1 12242 12243
12243 12242  H      9.734069  -35.533585    5.457420     2 12241
12244 12243  H      9.313025  -36.611570    4.481425     2 12241
12245 12244  O      9.792379   36.013530    8.215014     1 12245 12246
12246 12245  H     10.226171   36.571403    8.860640     2 12244
12247 12246  H      8.985103   36.480064    7.998491     2 12244
12248 12247  O     24.510031   -0.922253    9.986950     1 12248 12249
12249 12248  H     24.437025   -1.597319    9.312274     2 12247
12250 12249  H     25.126073   -0.285858    9.624010     2 12247
12251 12250  O     22.651562   -6.993094    1.088910     1 12251 12252
12252 12251  H     21.906139   -7.417994    1.513217     2 12250
12253 12252  H     22.291103   -6.185279    0.723210     2 12250
12254 12253  O      9.433314   -4.411493   17.554490     1 12254 12255
12255 12254  H      9.241391   -5.315310   17.804516     2 12253
12256 12255  H      9.003438   -3.880569   18.224981     2 12253
12257 12256  O      9.811886   -6.161651   13.696892     1 12257 12258
12258 12257  H      9.118106   -6.540371   14.236774     2 12256
12259 12258  H      9.353129   -5.785652   12.945628     2 12256
12260 12259  O      4.147413  -31.603184    2.261091     1 12260 12261
12261 12260  H      5.049886  -31.792621    2.004402     2 12259
12262 12261  H      4.007282  -32.126988    3.049903     2 12259
12263 12262  O     -8.921945   33.563726  -11.378114     1 12263 12264
12264 12263  H     -9.806122   33.656918  -11.023464     2 12262
12265 12264  H     -8.354901   33.544841  -10.607181     2 12262
12266 12265  O      8.043125  -34.214961    9.869401     1 12266 12267
12267 12266  H      7.533545  -33.560290    9.391943     2 12265
12268 12267  H      8.840237  -33.754312   10.131406     2 12265
12269 12268  O      6.637713   -8.310119   35.055711     1 12269 12270
12270 12269  H      7.039778   -7.449544   34.937449     2 12268
12271 12270  H      7.322437   -8.931109   34.807204     2 12268
12272 12271  O     -4.855161   13.606732  -33.733898     1 12272 12273
12273 12272  H     -5.417357   12.908089  -33.399137     2 12271
12274 12273  H     -5.319141   14.414458  -33.513595     2 12271
12275 12274  O      5.789901  -24.116399   20.243066     1 12275 12276
12276 12275  H      5.254689  -24.718731   20.759763     2 12274
12277 12276  H      6.679650  -24.242989   20.572541     2 12274
12278 12277  O      9.326815  -31.248419    7.049903     1 12278 12279
12279 12278  H     10.196127  -30.851057    7.101211     2 12277
12280 12279  H      9.004050  -31.008255    6.181356     2 12277
12281 12280  O      9.357476  -12.541454    6.093908     1 12281 12282
12282 12281  H      9.293324  -13.335336    6.624822     2 12280
12283 12282  H      9.317018  -11.825107    6.727503     2 12280
12284 12283  O      8.134873  -17.638893   14.409892     1 12284 12285
12285 12284  H      7.676262  -17.500254   13.581226     2 12283
12286 12285  H      8.320895  -18.577686   14.427089     2 12283
12287 12286  O     13.682562  -26.286905    0.894348     1 12287 12288
12288 12287  H     14.307280  -26.782634    1.423700     2 12286
12289 12288  H     13.018905  -26.928985    0.642311     2 12286
12290 12289  O     20.879716   -5.173988   12.673821     1 12290 12291
12291 12290  H     20.590415   -5.077148   13.581102     2 12289
12292 12291  H     20.638024   -6.069961   12.439195     2 12289
12293 12292  O    -28.196310   -7.688516  -18.264228     1 12293 12294
12294 12293  H    -28.298999   -6.748836  -18.414857     2 12292
12295 12294  H    -28.625261   -8.100112  -19.014441     2 12292
12296 12295  O     28.760183   -2.797594   19.842984     1 12296 12297
12297 12296  H     29.650353   -2.518445   19.628727     2 12295
12298 12297  H     28.343145   -2.014640   20.202561     2 12295
12299 12298  O     15.530210    0.156714  -35.208744     1 12299 12300
12300 12299  H     16.223831    0.782087  -35.418580     2 12298
12301 12300  H     15.964733   -0.517121  -34.685897     2 12298
12302 12301  O      4.154656   -5.715024   14.578600     1 12302 12303
12303 12302  H      4.458215   -6.622507   14.602220     2 12301
12304 12303  H      4.957117   -5.194362   14.543989     2 12301
12305 12304  O     20.774272  -20.565830    9.923606     1 12305 12306
12306 12305  H     20.025044  -20.723394   10.498117     2 12304
12307 12306  H     20.587028  -21.080342    9.138464     2 12304
12308 12307  O     11.813136   -7.413297   29.203009     1 12308 12309
12309 12308  H     11.244130   -6.771779   28.777665     2 12307
12310 12309  H     11.555603   -7.388771   30.124587     2 12307
12311 12310  O      3.378932   -9.522049   -3.562758     1 12311 12312
12312 12311  H      3.880915  -10.244727   -3.185955     2 12310
12313 12312  H      3.028050   -9.053144   -2.805630     2 12310
12314 12313  O      6.361374  -26.345763   11.384805     1 12314 12315
12315 12314  H      5.836290  -25.930512   12.068972     2 12313
12316 12315  H      6.683981  -27.152571   11.786327     2 12313
12317 12316  O     14.867370   -1.738869   20.811191     1 12317 12318
12318 12317  H     15.740447   -2.121948   20.726234     2 12316
12319 12318  H     14.360804   -2.136698   20.103127     2 12316
12320 12319  O    -12.757648   13.055326  -27.334663     1 12320 12321
12321 12320  H    -12.728488   13.100687  -28.290342     2 12319
12322 12321  H    -13.688413   12.974106  -27.126549     2 12319
12323 12322  O      7.968571  -22.940124   12.610732     1 12323 12324
12324 12323  H      7.400481  -22.179196   12.490344     2 12322
12325 12324  H      7.911129  -23.415984   11.782186     2 12322
12326 12325  O     22.413903   -0.323386   11.763515     1 12326 12327
12327 12326  H     23.294180   -0.441485   11.406588     2 12325
12328 12327  H     22.313579   -1.035448   12.395287     2 12325
12329 12328  O     -1.569383   27.857096  -20.778766     1 12329 12330
12330 12329  H     -1.043947   27.079271  -20.966216     2 12328
12331 12330  H     -1.638906   28.308223  -21.620123     2 12328
12332 12331  O     27.411969  -21.220653   -3.963761     1 12332 12333
12333 12332  H     27.536735  -21.063108   -4.899626     2 12331
12334 12333  H     28.210044  -20.885136   -3.555426     2 12331
12335 12334  O    -26.103436    3.292884  -24.992796     1 12335 12336
12336 12335  H    -25.590597    3.491962  -24.209473     2 12334
12337 12336  H    -26.459682    4.137771  -25.267545     2 12334
12338 12337  O      8.195386   -7.576188   15.793741     1 12338 12339
12339 12338  H      9.072598   -7.957355   15.831715     2 12337
12340 12339  H      8.067639   -7.181575   16.656407     2 12337
12341 12340  O      4.790306   -3.297886   17.531442     1 12341 12342
12342 12341  H      5.288772   -2.519814   17.781179     2 12340
12343 12342  H      3.900225   -3.120538   17.835635     2 12340
12344 12343  O      6.062746  -18.089874   21.864694     1 12344 12345
12345 12344  H      5.762860  -18.244345   22.760484     2 12343
12346 12345  H      6.362582  -17.180848   21.865385     2 12343
12347 12346  O      0.798709  -18.292345    7.037319     1 12347 12348
12348 12347  H      1.723553  -18.055480    6.968099     2 12346
12349 12348  H      0.744286  -19.164096    6.645759     2 12346
12350 12349  O      7.568425   -7.997075    1.206452     1 12350 12351
12351 12350  H      6.797514   -8.160421    1.749818     2 12349
12352 12351  H      8.297504   -7.970404    1.826100     2 12349
12353 12352  O      2.759876  -20.636552   15.403919     1 12353 12354
12354 12353  H      2.139541  -20.905694   14.726439     2 12352
12355 12354  H      3.459160  -20.190990   14.925685     2 12352
12356 12355  O    -34.319489   -2.781912   13.904596     1 12356 12357
12357 12356  H    -34.338608   -2.831522   12.948874     2 12355
12358 12357  H    -33.397342   -2.641127   14.119200     2 12355
12359 12358  O     11.395327   -8.074666   12.173549     1 12359 12360
12360 12359  H     11.796408   -8.038387   11.305189     2 12358
12361 12360  H     12.129024   -8.219885   12.770903     2 12358
12362 12361  O    -33.592516   -3.479532    6.575405     1 12362 12363
12363 12362  H    -33.875945   -4.035527    5.849617     2 12361
12364 12363  H    -34.186857   -2.729650    6.549556     2 12361
12365 12364  O     -0.872090   -6.378202   15.379475     1 12365 12366
12366 12365  H      0.062783   -6.173618   15.399230     2 12364
12367 12366  H     -0.916417   -7.263632   15.018530     2 12364
12368 12367  O      1.731493  -22.762583   21.822289     1 12368 12369
12369 12368  H      1.581663  -23.349849   21.081411     2 12367
12370 12369  H      2.407700  -22.158078   21.516429     2 12367
12371 12370  O    -17.113134   18.395558  -17.058519     1 12371 12372
12372 12371  H    -16.271902   18.845906  -16.982708     2 12370
12373 12372  H    -17.731213   19.082189  -17.309014     2 12370
12374 12373  O     23.899322  -10.088565    2.695481     1 12374 12375
12375 12374  H     23.265509   -9.764980    2.055320     2 12373
12376 12375  H     23.594500  -10.970077    2.910539     2 12373
12377 12376  O      7.616811  -11.198803   17.342413     1 12377 12378
12378 12377  H      7.021908  -11.419492   18.059085     2 12376
12379 12378  H      7.040039  -10.977419   16.611280     2 12376
12380 12379  O    -35.246648   14.756343   -0.044936     1 12380 12381
12381 12380  H    -35.941196   15.201121    0.440871     2 12379
12382 12381  H    -34.806044   15.455478   -0.527957     2 12379
12383 12382  O     -2.379037  -17.232270    7.344922     1 12383 12384
12384 12383  H     -2.437856  -16.289494    7.190180     2 12382
12385 12384  H     -1.891933  -17.568978    6.592866     2 12382
12386 12385  O      9.845778   -9.831545   18.056979     1 12386 12387
12387 12386  H      8.976625  -10.161451   17.829016     2 12385
12388 12387  H      9.720267   -8.890863   18.181859     2 12385
12389 12388  O     12.424550   28.866876    7.480723     1 12389 12390
12390 12389  H     12.033262   29.256991    8.262346     2 12388
12391 12390  H     11.746133   28.285384    7.137432     2 12388
12392 12391  O      2.887689   -0.689694   20.273291     1 12392 12393
12393 12392  H      2.135285   -0.423114   20.801548     2 12391
12394 12393  H      3.487689   -1.096559   20.898345     2 12391
12395 12394  O     19.718848  -22.803638   -1.634169     1 12395 12396
12396 12395  H     18.817505  -22.717466   -1.323709     2 12394
12397 12396  H     19.634905  -22.956681   -2.575319     2 12394
12398 12397  O     20.353465  -13.293335   -1.241299     1 12398 12399
12399 12398  H     20.734361  -13.087478   -0.387618     2 12397
12400 12399  H     19.644120  -13.905713   -1.046222     2 12397
12401 12400  O      4.756250   -6.223508    1.873781     1 12401 12402
12402 12401  H      4.397403   -5.344433    1.994975     2 12400
12403 12402  H      5.514563   -6.255680    2.457011     2 12400
12404 12403  O      6.662719   -4.927365   20.263056     1 12404 12405
12405 12404  H      7.133489   -4.111012   20.095202     2 12403
12406 12405  H      6.566180   -4.957374   21.214902     2 12403
12407 12406  O      5.108841  -31.797758    6.318458     1 12407 12408
12408 12407  H      5.720661  -31.905179    5.590194     2 12406
12409 12408  H      5.591900  -32.106021    7.085179     2 12406
12410 12409  O     12.801612  -34.880198    5.833560     1 12410 12411
12411 12410  H     11.959924  -34.753566    6.271461     2 12409
12412 12411  H     12.623486  -34.691845    4.912134     2 12409
12413 12412  O      7.315564   -6.787947    6.206664     1 12413 12414
12414 12413  H      6.725429   -6.296382    5.635406     2 12412
12415 12414  H      8.169448   -6.373285    6.083502     2 12412
12416 12415  O      7.050963   -8.320925   26.159377     1 12416 12417
12417 12416  H      7.468756   -8.293015   27.020133     2 12415
12418 12417  H      6.245804   -7.814573   26.266889     2 12415
12419 12418  O    -23.032472   18.659701   -6.070673     1 12419 12420
12420 12419  H    -22.384326   17.985215   -5.867674     2 12418
12421 12420  H    -22.851974   18.900230   -6.979407     2 12418
12422 12421  O     -4.416060  -18.567700    8.702017     1 12422 12423
12423 12422  H     -3.889950  -18.260810    7.963601     2 12421
12424 12423  H     -4.186715  -17.979076    9.421150     2 12421
12425 12424  O      6.114020   -7.392683    8.505594     1 12425 12426
12426 12425  H      6.545395   -7.066468    7.715828     2 12424
12427 12426  H      6.391322   -6.790983    9.196458     2 12424
12428 12427  O     13.506917  -15.905845   14.123153     1 12428 12429
12429 12428  H     13.300130  -16.817574   13.917676     2 12427
12430 12429  H     13.662882  -15.902103   15.067554     2 12427
12431 12430  O    -28.042002   24.912497   -0.718207     1 12431 12432
12432 12431  H    -28.114845   25.010591   -1.667576     2 12430
12433 12432  H    -27.493453   24.137269   -0.598429     2 12430
12434 12433  O     13.788451  -23.029609    6.983230     1 12434 12435
12435 12434  H     12.937557  -22.881826    7.395990     2 12433
12436 12435  H     14.421739  -22.918090    7.692272     2 12433
12437 12436  O    -21.142946    8.536880  -18.711052     1 12437 12438
12438 12437  H    -22.087552    8.383454  -18.731362     2 12436
12439 12438  H    -20.849059    8.117670  -17.902272     2 12436
12440 12439  O    -23.528024   18.680500   -3.065133     1 12440 12441
12441 12440  H    -23.044629   19.438655   -2.736862     2 12439
12442 12441  H    -23.439350   18.733015   -4.016769     2 12439
12443 12442  O     30.136175  -12.397067   -2.381797     1 12443 12444
12444 12443  H     30.044026  -11.824450   -3.143275     2 12442
12445 12444  H     29.406108  -12.156941   -1.811207     2 12442
12446 12445  O     -1.757053  -23.868718   -2.272100     1 12446 12447
12447 12446  H     -1.416998  -22.974000   -2.280636     2 12445
12448 12447  H     -1.946809  -24.062103   -3.190156     2 12445
12449 12448  O     14.830441  -16.641479   -0.430567     1 12449 12450
12450 12449  H     15.148466  -15.806264   -0.773362     2 12448
12451 12450  H     15.612445  -17.190401   -0.372384     2 12448
12452 12451  O      7.668431   -6.548531   -0.955047     1 12452 12453
12453 12452  H      7.588861   -6.735045   -0.019573     2 12451
12454 12453  H      8.515194   -6.919915   -1.202630     2 12451
12455 12454  O     -1.100683  -22.620449   26.290553     1 12455 12456
12456 12455  H     -1.169969  -21.777944   26.739570     2 12454
12457 12456  H     -0.642169  -22.420462   25.474464     2 12454
12458 12457  O     23.169387   -6.677800   16.488143     1 12458 12459
12459 12458  H     23.582581   -6.063646   17.095035     2 12457
12460 12459  H     23.869679   -7.283802   16.246100     2 12457
12461 12460  O     19.853752  -14.012308   17.218357     1 12461 12462
12462 12461  H     19.541656  -13.316067   17.796349     2 12460
12463 12462  H     19.982611  -14.764325   17.796368     2 12460
12464 12463  O     35.571102    2.092280   10.766542     1 12464 12465
12465 12464  H     34.896755    2.404321   10.163120     2 12463
12466 12465  H     35.083271    1.753255   11.517085     2 12463
12467 12466  O      2.274230   -5.801663   33.003299     1 12467 12468
12468 12467  H      3.063296   -6.212029   32.649455     2 12466
12469 12468  H      1.905510   -6.459340   33.592993     2 12466
12470 12469  O      1.505382  -31.342142    5.352106     1 12470 12471
12471 12470  H      1.604975  -30.592418    4.765399     2 12469
12472 12471  H      2.124600  -31.174795    6.062597     2 12469
12473 12472  O     -0.651198  -12.119573   24.278530     1 12473 12474
12474 12473  H     -1.184418  -11.362838   24.035098     2 12472
12475 12474  H     -0.410589  -12.522037   23.444047     2 12472
12476 12475  O     12.583094  -23.518541   11.447976     1 12476 12477
12477 12476  H     12.921993  -23.213658   10.606296     2 12475
12478 12477  H     11.919431  -24.168882   11.218106     2 12475
12479 12478  O     17.374577   -3.510108   20.263120     1 12479 12480
12480 12479  H     18.299972   -3.429800   20.031979     2 12478
12481 12480  H     17.357837   -4.162664   20.963208     2 12478
12482 12481  O     -1.665822  -18.238482   26.028872     1 12482 12483
12483 12482  H     -2.470951  -18.277244   26.545105     2 12481
12484 12483  H     -1.632863  -17.339129   25.702820     2 12481
12485 12484  O     10.585871  -33.624156    6.832560     1 12485 12486
12486 12485  H      9.897962  -32.977866    6.991690     2 12484
12487 12486  H     10.766616  -33.999410    7.694389     2 12484
12488 12487  O     -7.579942   13.317474  -27.024461     1 12488 12489
12489 12488  H     -6.952194   13.017158  -27.681709     2 12487
12490 12489  H     -7.972420   12.514099  -26.682727     2 12487
12491 12490  O      3.064399    0.325084   26.452953     1 12491 12492
12492 12491  H      2.982306    1.271788   26.568036     2 12490
12493 12492  H      2.412236   -0.046337   27.047057     2 12490
12494 12493  O      0.253867   -5.135306   -0.788463     1 12494 12495
12495 12494  H      0.714586   -4.402444   -1.196976     2 12493
12496 12495  H     -0.526178   -5.259734   -1.329092     2 12493
12497 12496  O     -6.781441   20.269724  -27.337535     1 12497 12498
12498 12497  H     -7.375512   20.690191  -26.715829     2 12496
12499 12498  H     -7.344925   19.697701  -27.858599     2 12496
12500 12499  O      7.326537   -8.804062   12.876437     1 12500 12501
12501 12500  H      7.904682   -8.460929   13.557789     2 12499
12502 12501  H      7.370014   -8.154110   12.175078     2 12499
12503 12502  O     19.556666  -17.731040    1.554647     1 12503 12504
12504 12503  H     18.973988  -18.469032    1.375521     2 12502
12505 12504  H     20.430772  -18.119235    1.593049     2 12502
12506 12505  O     24.378344  -17.349757    4.809111     1 12506 12507
12507 12506  H     23.677384  -17.999974    4.763243     2 12505
12508 12507  H     24.913926  -17.519173    4.034075     2 12505
12509 12508  O     14.730238  -21.690914    4.712731     1 12509 12510
12510 12509  H     14.364345  -22.007113    5.538789     2 12508
12511 12510  H     14.941536  -22.486235    4.223803     2 12508
12512 12511  O     29.627161   -4.924606   -4.208125     1 12512 12513
12513 12512  H     30.006560   -4.460479   -4.954365     2 12511
12514 12513  H     30.127550   -4.614828   -3.453222     2 12511
12515 12514  O     11.717795  -10.482204   20.253828     1 12515 12516
12516 12515  H     10.962656  -10.177260   19.750831     2 12514
12517 12516  H     11.759252   -9.891873   21.006173     2 12514
12518 12517  O     12.885825   -6.237650   13.933455     1 12518 12519
12519 12518  H     13.188946   -5.576812   14.556064     2 12517
12520 12519  H     11.935314   -6.127158   13.909983     2 12517
12521 12520  O      6.093533   -4.260793   22.826368     1 12521 12522
12522 12521  H      5.584049   -3.450452   22.828643     2 12520
12523 12522  H      6.685213   -4.174367   23.573815     2 12520
12524 12523  O      1.747137  -21.539260   12.971268     1 12524 12525
12525 12524  H      1.731429  -20.815746   12.344760     2 12523
12526 12525  H      2.522008  -22.047526   12.731537     2 12523
12527 12526  O     27.737621   -6.087029   10.940431     1 12527 12528
12528 12527  H     28.385530   -6.780609   10.816366     2 12526
12529 12528  H     28.250450   -5.324890   11.209470     2 12526
12530 12529  O      6.685984  -21.589897   19.135584     1 12530 12531
12531 12530  H      6.392594  -22.272822   19.738715     2 12529
12532 12531  H      7.418098  -21.985667   18.662714     2 12529
12533 12532  O      1.656176   -8.978129   31.978191     1 12533 12534
12534 12533  H      1.229025   -8.839610   32.823522     2 12532
12535 12534  H      1.116057   -9.636726   31.541438     2 12532
12536 12535  O     21.241262  -12.002313    1.063165     1 12536 12537
12537 12536  H     21.361089  -11.169901    0.606039     2 12535
12538 12537  H     20.639086  -11.798603    1.778789     2 12535
12539 12538  O     18.531688   -4.335418   25.009422     1 12539 12540
12540 12539  H     18.604829   -4.481093   25.952640     2 12538
12541 12540  H     17.898824   -3.622253   24.925097     2 12538
12542 12541  O      8.586286   -6.009433   23.295091     1 12542 12543
12543 12542  H      8.138401   -5.531623   23.993180     2 12541
12544 12543  H      8.371690   -5.525876   22.497373     2 12541
12545 12544  O     13.726552  -25.784900    6.704640     1 12545 12546
12546 12545  H     12.799866  -25.823872    6.941213     2 12544
12547 12546  H     13.930648  -24.849876    6.687127     2 12544
12548 12547  O     20.107753  -11.220171    3.612794     1 12548 12549
12549 12548  H     19.719705  -10.374641    3.838027     2 12547
12550 12549  H     19.377272  -11.837506    3.651851     2 12547
12551 12550  O      0.970397   -9.297688    9.141951     1 12551 12552
12552 12551  H      0.954660  -10.223249    9.385509     2 12550
12553 12552  H      0.985132   -8.830010    9.976992     2 12550
12554 12553  O      6.543963   -3.734129   15.450529     1 12554 12555
12555 12554  H      5.896733   -3.607493   16.144279     2 12553
12556 12555  H      7.146412   -2.996556   15.546822     2 12553
12557 12556  O      0.280205  -36.001548   11.204910     1 12557 12558
12558 12557  H      0.454081  -36.268776   12.107455     2 12556
12559 12558  H      0.877552  -35.269390   11.052090     2 12556
12560 12559  O      4.269841  -12.326684   21.047963     1 12560 12561
12561 12560  H      3.663184  -12.672556   21.702617     2 12559
12562 12561  H      5.107273  -12.262346   21.507092     2 12559
12563 12562  O     21.248322  -29.088094   -3.517193     1 12563 12564
12564 12563  H     21.818272  -28.380952   -3.214971     2 12562
12565 12564  H     21.795467  -29.598993   -4.113721     2 12562
12566 12565  O     12.150268    1.173903   28.021817     1 12566 12567
12567 12566  H     12.151832    2.118154   28.178721     2 12565
12568 12567  H     11.496177    0.830562   28.630516     2 12565
12569 12568  O     19.495176  -19.117674    6.512615     1 12569 12570
12570 12569  H     19.074287  -18.515791    7.126471     2 12568
12571 12570  H     19.785222  -19.850509    7.055807     2 12568
12572 12571  O      8.779681  -18.759950   24.342823     1 12572 12573
12573 12572  H      8.603242  -17.828795   24.208471     2 12571
12574 12573  H      9.730649  -18.837516   24.266173     2 12571
12575 12574  O      7.675428  -11.643499   10.427962     1 12575 12576
12576 12575  H      6.993776  -11.134422    9.989300     2 12574
12577 12576  H      8.270395  -10.986570   10.789473     2 12574
12578 12577  O     11.099102    1.177929   34.075025     1 12578 12579
12579 12578  H     10.946959    0.232898   34.074838     2 12577
12580 12579  H     10.953673    1.444598   33.167297     2 12577
12581 12580  O      9.936642  -10.265333   11.147446     1 12581 12582
12582 12581  H     10.733948  -10.094995   10.645930     2 12580
12583 12582  H      9.997054   -9.678145   11.900967     2 12580
12584 12583  O     -2.867595  -20.096844    5.684922     1 12584 12585
12585 12584  H     -2.137857  -20.518868    5.231481     2 12583
12586 12585  H     -3.172422  -20.752991    6.311646     2 12583
12587 12586  O     13.473633  -20.692612    9.443270     1 12587 12588
12588 12587  H     13.483530  -19.852557    8.984531     2 12586
12589 12588  H     12.619631  -21.070600    9.233418     2 12586
12590 12589  O     16.673594    4.821855   28.892543     1 12590 12591
12591 12590  H     16.567583    5.399591   28.136757     2 12589
12592 12591  H     17.060563    4.023931   28.532261     2 12589
12593 12592  O     17.824300  -12.602564   18.810887     1 12593 12594
12594 12593  H     17.014129  -12.581082   19.320193     2 12592
12595 12594  H     18.412366  -12.002886   19.270012     2 12592
12596 12595  O      5.258883   -7.975516   15.029644     1 12596 12597
12597 12596  H      6.155174   -7.644482   15.087181     2 12595
12598 12597  H      5.359412   -8.911528   14.856415     2 12595
12599 12598  O     25.117857  -12.190918   15.001032     1 12599 12600
12600 12599  H     25.987558  -11.935532   15.308650     2 12598
12601 12600  H     25.286783  -12.806060   14.287382     2 12598
12602 12601  O      3.961251  -10.306522   24.888092     1 12602 12603
12603 12602  H      3.603386  -11.155173   25.148773     2 12601
12604 12603  H      3.331106   -9.667731   25.221403     2 12601
12605 12604  O     -0.170967  -19.970799   -5.246233     1 12605 12606
12606 12605  H     -1.028543  -20.249488   -4.925098     2 12604
12607 12606  H     -0.016860  -20.512557   -6.020172     2 12604
12608 12607  O      4.511105  -25.440319   13.833262     1 12608 12609
12609 12608  H      3.775155  -25.933008   14.196397     2 12607
12610 12609  H      4.911208  -25.013377   14.590804     2 12607
12611 12610  O      7.932654   -3.888440   24.908028     1 12611 12612
12612 12611  H      8.290108   -3.749160   25.784988     2 12610
12613 12612  H      7.918879   -3.016562   24.513223     2 12610
12614 12613  O     13.034185   -9.392211    9.868977     1 12614 12615
12615 12614  H     13.977504   -9.326839    9.720293     2 12613
12616 12615  H     12.934450  -10.146746   10.449461     2 12613
12617 12616  O     -5.869501   12.683113  -29.078136     1 12617 12618
12618 12617  H     -6.233173   13.388034  -29.613917     2 12616
12619 12618  H     -5.246752   12.240336  -29.654646     2 12616
12620 12619  O     31.922107  -11.276548   -7.145128     1 12620 12621
12621 12620  H     31.500656  -11.329956   -8.002892     2 12619
12622 12621  H     31.592767  -10.461552   -6.766249     2 12619
12623 12622  O      9.458956   -6.896654   10.526937     1 12623 12624
12624 12623  H      9.588120   -7.668256    9.975414     2 12622
12625 12624  H     10.005262   -7.057422   11.296311     2 12622
12626 12625  O     10.078845    0.153592   22.167652     1 12626 12627
12627 12626  H     10.574040   -0.392455   22.778263     2 12625
12628 12627  H     10.406216    1.040267   22.318874     2 12625
12629 12628  O    -19.622421    6.396677  -25.601586     1 12629 12630
12630 12629  H    -19.320395    6.498894  -26.504117     2 12628
12631 12630  H    -20.278842    5.701395  -25.645474     2 12628
12632 12631  O     18.515382  -10.045157   11.129107     1 12632 12633
12633 12632  H     19.239141  -10.349456   11.676654     2 12631
12634 12633  H     18.768640  -10.289586   10.238969     2 12631
12635 12634  O     11.792154  -28.611421    0.491852     1 12635 12636
12636 12635  H     11.711315  -29.346532   -0.115855     2 12634
12637 12636  H     11.133145  -27.982850    0.197171     2 12634
12638 12637  O     -0.417527  -15.267307   -2.392870     1 12638 12639
12639 12638  H     -0.682281  -16.186785   -2.366457     2 12637
12640 12639  H     -0.470405  -15.028835   -3.318379     2 12637
12641 12640  O     11.127596  -24.516988   14.981996     1 12641 12642
12642 12641  H     10.653705  -23.693743   14.863987     2 12640
12643 12642  H     10.510126  -25.085501   15.442165     2 12640
12644 12643  O      1.215495  -12.057234   34.594584     1 12644 12645
12645 12644  H      1.696230  -12.764944   35.023853     2 12643
12646 12645  H      1.734560  -11.851668   33.817058     2 12643
12647 12646  O     12.815870   -7.012864   24.455865     1 12647 12648
12648 12647  H     12.049817   -7.024527   25.029675     2 12646
12649 12648  H     13.515658   -7.399926   24.981900     2 12646
12650 12649  O    -28.044284    2.419972  -23.179470     1 12650 12651
12651 12650  H    -28.507671    1.645393  -23.498112     2 12649
12652 12651  H    -27.432065    2.639228  -23.881856     2 12649
12653 12652  O      9.724926  -15.562303   15.470819     1 12653 12654
12654 12653  H      9.476617  -16.297454   14.910349     2 12652
12655 12654  H      8.911409  -15.075366   15.602402     2 12652
12656 12655  O     13.190907  -11.543729   11.391295     1 12656 12657
12657 12656  H     13.126531  -11.773094   12.318376     2 12655
12658 12657  H     13.960551  -12.019632   11.079213     2 12655
12659 12658  O      3.131689   36.015010    7.559520     1 12659 12660
12660 12659  H      4.066407   36.041592    7.355002     2 12658
12661 12660  H      2.765518   35.395217    6.928642     2 12658
12662 12661  O     11.567277  -27.418959    9.075439     1 12662 12663
12663 12662  H     11.595828  -27.719193    8.166992     2 12661
12664 12663  H     12.226557  -27.948449    9.524018     2 12661
12665 12664  O      3.495803  -15.584741    4.856509     1 12665 12666
12666 12665  H      3.909401  -14.780850    4.541981     2 12664
12667 12666  H      3.544370  -15.522256    5.810431     2 12664
12668 12667  O    -13.864506   14.209240  -21.455867     1 12668 12669
12669 12668  H    -14.650026   14.173674  -20.910040     2 12667
12670 12669  H    -13.187529   14.563622  -20.879373     2 12667
12671 12670  O      3.800450   -6.186758   23.731170     1 12671 12672
12672 12671  H      4.243141   -5.927571   22.923037     2 12670
12673 12672  H      3.682870   -5.368364   24.213493     2 12670
12674 12673  O     12.074146   -3.993617   26.833513     1 12674 12675
12675 12674  H     12.984576   -4.287195   26.799443     2 12673
12676 12675  H     11.838074   -3.837134   25.919175     2 12673
12677 12676  O    -26.217739   22.308508   -0.856386     1 12677 12678
12678 12677  H    -26.467666   21.420551   -0.600847     2 12676
12679 12678  H    -25.932271   22.225031   -1.766205     2 12676
12680 12679  O     10.224628  -19.838453   17.439961     1 12680 12681
12681 12680  H      9.959290  -19.256537   18.152141     2 12679
12682 12681  H     10.596984  -20.602410   17.880360     2 12679
12683 12682  O     -2.858500    5.277565    6.772179     1 12683 12684
12684 12683  H     -2.750791    4.449041    6.305083     2 12682
12685 12684  H     -2.048716    5.757686    6.599078     2 12682
12686 12685  O      1.118215  -19.843273   11.015083     1 12686 12687
12687 12686  H      0.769676  -19.092117   10.534961     2 12685
12688 12687  H      0.736366  -20.605011   10.578988     2 12685
12689 12688  O     -5.743327   23.401980  -24.718652     1 12689 12690
12690 12689  H     -6.682211   23.580725  -24.665941     2 12688
12691 12690  H     -5.584249   22.750882  -24.035280     2 12688
12692 12691  O      4.838309  -21.890381   22.978221     1 12692 12693
12693 12692  H      4.958657  -21.176337   23.604231     2 12691
12694 12693  H      4.149078  -21.580740   22.390586     2 12691
12695 12694  O      3.702282  -15.887730   21.139145     1 12695 12696
12696 12695  H      4.574031  -15.720034   21.497146     2 12694
12697 12696  H      3.740714  -16.791943   20.827451     2 12694
12698 12697  O    -21.740843    4.527939  -26.238118     1 12698 12699
12699 12698  H    -21.289597    4.154570  -26.995220     2 12697
12700 12699  H    -22.007208    3.768999  -25.719185     2 12697
12701 12700  O      4.067398  -25.405548    1.244493     1 12701 12702
12702 12701  H      4.599265  -25.718422    1.976244     2 12700
12703 12702  H      3.171708  -25.404390    1.582088     2 12700
12704 12703  O      3.892076  -32.023753    9.741805     1 12704 12705
12705 12704  H      3.167965  -31.608609    9.273243     2 12703
12706 12705  H      4.549248  -31.333193    9.828310     2 12703
12707 12706  O     24.417720  -10.077007    5.512262     1 12707 12708
12708 12707  H     24.439731   -9.889066    4.573952     2 12706
12709 12708  H     23.522443  -10.373056    5.676782     2 12706
12710 12709  O     11.616271   -1.557843   18.156142     1 12710 12711
12711 12710  H     11.658840   -1.589021   17.200398     2 12709
12712 12711  H     10.710791   -1.314026   18.348211     2 12709
12713 12712  O      3.030021  -34.943997    3.430685     1 12713 12714
12714 12713  H      3.148351  -35.871744    3.634441     2 12712
12715 12714  H      3.152505  -34.496849    4.268115     2 12712
12716 12715  O      4.297379   -0.389966    3.717185     1 12716 12717
12717 12716  H      4.656414   -0.374965    2.829998     2 12715
12718 12717  H      3.427371   -0.000322    3.630616     2 12715
12719 12718  O     15.135861  -23.228265    9.522776     1 12719 12720
12720 12719  H     15.320081  -22.372712    9.910491     2 12718
12721 12720  H     15.582304  -23.852257   10.095100     2 12718
12722 12721  O     21.773597  -19.187789    2.051523     1 12722 12723
12723 12722  H     22.327068  -19.936779    1.830353     2 12721
12724 12723  H     21.326701  -19.449075    2.856660     2 12721
12725 12724  O      4.888544  -13.848452   15.203358     1 12725 12726
12726 12725  H      4.392075  -13.039283   15.080905     2 12724
12727 12726  H      4.629323  -14.160170   16.070461     2 12724
12728 12727  O     25.301451  -22.062093    4.708868     1 12728 12729
12729 12728  H     25.445015  -21.772028    3.808044     2 12727
12730 12729  H     25.783183  -21.431206    5.243794     2 12727
12731 12730  O     -3.522224  -24.041682    0.362130     1 12731 12732
12732 12731  H     -3.645731  -23.452620    1.106430     2 12730
12733 12732  H     -2.757391  -23.692848   -0.095667     2 12730
12734 12733  O     13.511848   -2.743317   11.300470     1 12734 12735
12735 12734  H     13.236217   -3.359996   10.622261     2 12733
12736 12735  H     14.117578   -3.243279   11.847608     2 12733
12737 12736  O     -2.159038   -7.168144   -3.713614     1 12737 12738
12738 12737  H     -1.971282   -6.621226   -2.950816     2 12736
12739 12738  H     -1.435278   -7.793813   -3.744312     2 12736
12740 12739  O     -0.377495  -17.930654    9.331546     1 12740 12741
12741 12740  H     -1.229920  -17.646349    9.001737     2 12739
12742 12741  H      0.128014  -18.135486    8.544949     2 12739
12743 12742  O     33.959746   -3.009824    0.437853     1 12743 12744
12744 12743  H     33.483264   -2.221898    0.176379     2 12742
12745 12744  H     33.609019   -3.226814    1.301645     2 12742
12746 12745  O      0.691267  -19.858025   29.867343     1 12746 12747
12747 12746  H      0.804218  -20.157585   30.769416     2 12745
12748 12747  H      1.581877  -19.703167   29.552598     2 12745
12749 12748  O     -8.771155   31.280698   -5.713080     1 12749 12750
12750 12749  H     -8.294807   31.053449   -6.511629     2 12748
12751 12750  H     -8.305236   30.818850   -5.016053     2 12748
12752 12751  O      5.183095  -16.469082    9.817692     1 12752 12753
12753 12752  H      4.902360  -15.694024   10.304214     2 12751
12754 12753  H      6.098276  -16.295615    9.597272     2 12751
12755 12754  O     16.848577   -9.010216   15.452521     1 12755 12756
12756 12755  H     16.010130   -9.455734   15.573980     2 12754
12757 12756  H     17.503388   -9.651963   15.727501     2 12754
12758 12757  O    -24.556078   16.703856  -10.817116     1 12758 12759
12759 12758  H    -23.867569   17.163646  -11.297512     2 12757
12760 12759  H    -24.419019   15.780001  -11.026729     2 12757
12761 12760  O     12.555257  -21.931438   13.604016     1 12761 12762
12762 12761  H     11.956705  -21.223082   13.366952     2 12760
12763 12762  H     12.596029  -22.482790   12.822620     2 12760
12764 12763  O      5.662345  -30.395531   12.620335     1 12764 12765
12765 12764  H      5.229772  -31.206106   12.351859     2 12763
12766 12765  H      5.007868  -29.937545   13.147726     2 12763
12767 12766  O      9.522728  -26.497258   15.533772     1 12767 12768
12768 12767  H      9.296494  -27.292971   15.052221     2 12766
12769 12768  H      8.687264  -26.176654   15.873542     2 12766
12770 12769  O      9.551025  -21.202526    6.801762     1 12770 12771
12771 12770  H      9.008650  -21.966543    6.997567     2 12769
12772 12771  H      9.728703  -21.268450    5.863510     2 12769
12773 12772  O     33.028965   -6.196639   11.443403     1 12773 12774
12774 12773  H     33.467004   -6.517552   10.655134     2 12772
12775 12774  H     32.897008   -5.262554   11.281217     2 12772
12776 12775  O     12.585019   -8.574683   22.107561     1 12776 12777
12777 12776  H     12.887304   -8.474905   23.010279     2 12775
12778 12777  H     13.347394   -8.352223   21.573212     2 12775
12779 12778  O     20.642428    1.591299   -1.023308     1 12779 12780
12780 12779  H     19.905584    2.180434   -1.185207     2 12778
12781 12780  H     20.252110    0.717430   -1.007911     2 12778
12782 12781  O     26.438251   -9.904460    1.508932     1 12782 12783
12783 12782  H     25.777376  -10.085426    2.177308     2 12781
12784 12783  H     25.937570   -9.595923    0.753714     2 12781
12785 12784  O     -3.145835  -21.840326    7.944096     1 12785 12786
12786 12785  H     -2.638272  -22.042094    8.730163     2 12784
12787 12786  H     -4.012588  -21.601703    8.272775     2 12784
12788 12787  O    -17.265054   29.060065   -6.194409     1 12788 12789
12789 12788  H    -17.624474   29.707350   -5.587721     2 12787
12790 12789  H    -16.582893   29.531827   -6.672247     2 12787
12791 12790  O     15.383653  -27.731274    2.395267     1 12791 12792
12792 12791  H     15.585051  -28.522105    1.895010     2 12790
12793 12792  H     16.238244  -27.389168    2.657695     2 12790
12794 12793  O    -10.255794  -33.754429   -9.571319     1 12794 12795
12795 12794  H    -10.718780  -34.126343   -8.820615     2 12793
12796 12795  H    -10.187380  -34.478370  -10.193782     2 12793
12797 12796  O     10.719213   -3.019649   21.056610     1 12797 12798
12798 12797  H     11.312300   -3.761722   21.174111     2 12796
12799 12798  H     11.103374   -2.319503   21.584290     2 12796
12800 12799  O     -2.181436   -6.393480   -1.137358     1 12800 12801
12801 12800  H     -2.570689   -6.085452   -0.318925     2 12799
12802 12801  H     -1.718557   -7.195781   -0.895929     2 12799
12803 12802  O      8.375507  -15.753842   19.617436     1 12803 12804
12804 12803  H      8.703279  -14.859652   19.521412     2 12802
12805 12804  H      7.953038  -15.945786   18.780233     2 12802
12806 12805  O      8.588532  -29.971350    4.640133     1 12806 12807
12807 12806  H      9.511334  -29.921511    4.390767     2 12805
12808 12807  H      8.457060  -29.224402    5.224099     2 12805
12809 12808  O     34.623105   -2.400785    9.971134     1 12809 12810
12810 12809  H     35.097490   -3.167174    9.648895     2 12808
12811 12810  H     35.307061   -1.761446   10.170336     2 12808
12812 12811  O      0.776172   -7.254587   30.006639     1 12812 12813
12813 12812  H      1.562281   -7.079840   29.489214     2 12811
12814 12813  H      1.102359   -7.664724   30.807651     2 12811
12815 12814  O      0.857167   -6.126369   25.470147     1 12815 12816
12816 12815  H      0.313455   -6.210593   24.686875     2 12814
12817 12816  H      1.088674   -5.198165   25.502914     2 12814
12818 12817  O      6.346643  -29.943651   -0.823154     1 12818 12819
12819 12818  H      5.516638  -29.777646   -0.376203     2 12817
12820 12819  H      6.676651  -29.073579   -1.047437     2 12817
12821 12820  O     11.216159  -22.237720    8.671156     1 12821 12822
12822 12821  H     10.858678  -21.945189    7.832787     2 12820
12823 12822  H     10.542320  -22.010323    9.311830     2 12820
12824 12823  O     15.120817  -23.775395    2.990479     1 12824 12825
12825 12824  H     15.907322  -24.143932    2.588207     2 12823
12826 12825  H     14.649271  -24.533999    3.334565     2 12823
12827 12826  O     16.243420  -16.638621   16.434367     1 12827 12828
12828 12827  H     15.569400  -17.317664   16.405575     2 12826
12829 12828  H     16.745800  -16.832545   17.225720     2 12826
12830 12829  O      5.603216  -26.374032    6.001248     1 12830 12831
12831 12830  H      5.839729  -26.508643    5.083548     2 12829
12832 12831  H      4.954271  -25.670684    5.981147     2 12829
12833 12832  O     14.883258   -6.973414   12.002497     1 12833 12834
12834 12833  H     14.189695   -6.806707   12.640785     2 12832
12835 12834  H     15.121186   -7.890231   12.140589     2 12832
12836 12835  O     -4.396692   11.305640  -31.421662     1 12836 12837
12837 12836  H     -5.001930   11.124756  -32.140827     2 12835
12838 12837  H     -3.824982   11.996204  -31.757074     2 12835
12839 12838  O     18.293660  -22.978160    7.008876     1 12839 12840
12840 12839  H     18.608294  -23.805774    7.372597     2 12838
12841 12840  H     17.969174  -23.206755    6.137851     2 12838
12842 12841  O     16.110638   -9.330985   21.551437     1 12842 12843
12843 12842  H     16.854840   -8.838967   21.898298     2 12841
12844 12843  H     15.641487   -8.701888   21.003379     2 12841
12845 12844  O     26.313138  -16.053219    6.352200     1 12845 12846
12846 12845  H     25.735993  -15.296149    6.452094     2 12844
12847 12846  H     25.748201  -16.740800    5.999623     2 12844
12848 12847  O     -1.499319   33.843785   11.015999     1 12848 12849
12849 12848  H     -1.871209   33.459270   11.809774     2 12847
12850 12849  H     -1.641478   34.785075   11.115974     2 12847
12851 12850  O    -25.800293   19.218143   -6.596582     1 12851 12852
12852 12851  H    -24.866898   19.289118   -6.396664     2 12850
12853 12852  H    -25.844317   18.589193   -7.316802     2 12850
12854 12853  O    -26.005996    5.619540  -22.127943     1 12854 12855
12855 12854  H    -25.608502    6.322741  -22.641497     2 12853
12856 12855  H    -25.656882    5.740412  -21.244913     2 12853
12857 12856  O     -7.710502  -36.143379   -9.366181     1 12857 12858
12858 12857  H     -8.431460  -36.648757   -8.990623     2 12856
12859 12858  H     -7.574614  -35.424236   -8.749253     2 12856
12860 12859  O     30.400567   -3.778944    8.723201     1 12860 12861
12861 12860  H     30.394935   -4.036966    7.801451     2 12859
12862 12861  H     29.594623   -4.150882    9.081459     2 12859
12863 12862  O     15.992006  -12.179157   20.861291     1 12863 12864
12864 12863  H     15.041987  -12.246184   20.957222     2 12862
12865 12864  H     16.184760  -11.255283   21.021085     2 12862
12866 12865  O     20.766910  -16.829833    4.345424     1 12866 12867
12867 12866  H     20.992891  -17.740467    4.534921     2 12865
12868 12867  H     20.573619  -16.447425    5.201364     2 12865
12869 12868  O    -25.221121   13.141830  -14.293079     1 12869 12870
12870 12869  H    -25.766183   12.386366  -14.073052     2 12868
12871 12870  H    -25.707004   13.894588  -13.956173     2 12868
12872 12871  O    -12.925504   21.953061  -16.621974     1 12872 12873
12873 12872  H    -13.259215   22.209480  -17.481693     2 12871
12874 12873  H    -13.022570   22.738089  -16.082956     2 12871
12875 12874  O     -1.137725  -21.985014   22.893406     1 12875 12876
12876 12875  H     -0.812400  -22.867814   22.717166     2 12874
12877 12876  H     -0.582106  -21.414111   22.362757     2 12874
12878 12877  O    -21.132260   16.557286    0.542475     1 12878 12879
12879 12878  H    -20.873809   17.364836    0.986657     2 12877
12880 12879  H    -20.891760   16.699427   -0.373050     2 12877
12881 12880  O     10.314903  -12.889030   27.095313     1 12881 12882
12882 12881  H     10.610132  -12.004405   26.879652     2 12880
12883 12882  H      9.492649  -12.991134   26.616038     2 12880
12884 12883  O     -0.008424  -24.560700   23.103535     1 12884 12885
12885 12884  H      0.940939  -24.445982   23.145730     2 12883
12886 12885  H     -0.301062  -24.475119   24.010877     2 12883
12887 12886  O     -1.815250  -30.621429  -20.561765     1 12887 12888
12888 12887  H     -1.386078  -29.767827  -20.620124     2 12886
12889 12888  H     -2.748365  -30.427474  -20.650700     2 12886
12890 12889  O     28.568439   -3.215392   11.221173     1 12890 12891
12891 12890  H     27.658745   -3.192132   10.924275     2 12889
12892 12891  H     28.976137   -2.455790   10.805219     2 12889
12893 12892  O     17.536780   -5.504362   22.294854     1 12893 12894
12894 12893  H     17.891650   -4.979691   23.012503     2 12892
12895 12894  H     17.728295   -6.409176   22.541564     2 12892
12896 12895  O     14.073297   -0.940214   27.851744     1 12896 12897
12897 12896  H     14.268516   -1.712589   28.382364     2 12895
12898 12897  H     13.418395   -0.460143   28.358564     2 12895
12899 12898  O     17.783172   -2.519734   27.500894     1 12899 12900
12900 12899  H     17.247471   -2.321301   26.732857     2 12898
12901 12900  H     18.116354   -1.669330   27.787311     2 12898
12902 12901  O      1.617770   31.856670    7.671446     1 12902 12903
12903 12902  H      2.065300   32.674007    7.452564     2 12901
12904 12903  H      1.398493   31.944100    8.599080     2 12901
12905 12904  O      0.646414  -20.136917   32.539218     1 12905 12906
12906 12905  H      1.147778  -19.882168   33.313796     2 12904
12907 12906  H      0.771937  -21.083519   32.472728     2 12904
12908 12907  O     -1.017333  -17.392498   19.570418     1 12908 12909
12909 12908  H     -1.711120  -16.935815   20.046161     2 12907
12910 12909  H     -1.025831  -18.280515   19.927609     2 12907
12911 12910  O     15.305298   -2.769940    8.197631     1 12911 12912
12912 12911  H     15.836568   -2.114934    8.650347     2 12910
12913 12912  H     15.530902   -3.597397    8.622660     2 12910
12914 12913  O      1.940509   -1.227837    0.509595     1 12914 12915
12915 12914  H      2.865569   -1.154479    0.744360     2 12913
12916 12915  H      1.939233   -1.724480   -0.308681     2 12913
12917 12916  O      8.394186  -22.868059   16.685403     1 12917 12918
12918 12917  H      8.078024  -23.592135   16.145046     2 12916
12919 12918  H      8.455182  -22.127314   16.082239     2 12916
12920 12919  O      6.477494  -17.361604   12.246576     1 12920 12921
12921 12920  H      5.947555  -17.547844   11.471521     2 12919
12922 12921  H      6.141013  -16.526844   12.572442     2 12919
12923 12922  O     31.382892  -14.699584   -2.871397     1 12923 12924
12924 12923  H     30.863013  -14.015320   -2.449804     2 12922
12925 12924  H     31.640964  -14.321327   -3.711964     2 12922
12926 12925  O    -29.810795    4.347913  -18.955789     1 12926 12927
12927 12926  H    -29.264001    4.356755  -19.741390     2 12925
12928 12927  H    -29.661509    5.201828  -18.549864     2 12925
12929 12928  O      4.222154   -8.668857   22.696339     1 12929 12930
12930 12929  H      4.121809   -9.412163   23.291031     2 12928
12931 12930  H      4.170468   -7.899300   23.263211     2 12928
12932 12931  O      9.628361  -18.712762   10.453719     1 12932 12933
12933 12932  H      9.604321  -18.210543    9.639207     2 12931
12934 12933  H      9.646417  -18.049840   11.143965     2 12931
12935 12934  O     31.516594   -7.451627    7.649422     1 12935 12936
12936 12935  H     31.628361   -8.371194    7.890536     2 12934
12937 12936  H     31.418453   -7.463386    6.697340     2 12934
12938 12937  O     -6.088423  -10.815629   -3.474513     1 12938 12939
12939 12938  H     -5.271456  -10.319222   -3.523274     2 12937
12940 12939  H     -6.586649  -10.533786   -4.241693     2 12937
12941 12940  O     26.040375   -8.596080    7.814426     1 12941 12942
12942 12941  H     26.366882   -7.789691    7.415226     2 12940
12943 12942  H     26.784937   -9.196915    7.785152     2 12940
12944 12943  O     27.910108   -1.894667    3.796792     1 12944 12945
12945 12944  H     28.255700   -1.183079    3.257868     2 12943
12946 12945  H     27.127406   -1.526725    4.206948     2 12943
12947 12946  O     18.177536  -13.252063    6.995993     1 12947 12948
12948 12947  H     17.562608  -13.901951    7.336197     2 12946
12949 12948  H     17.957656  -13.176617    6.067450     2 12946
12950 12949  O      3.489801  -14.117609    2.092393     1 12950 12951
12951 12950  H      3.709793  -13.186970    2.134172     2 12949
12952 12951  H      2.533028  -14.139121    2.111220     2 12949
12953 12952  O     17.151921  -12.589157   24.742091     1 12953 12954
12954 12953  H     16.927875  -13.128956   23.984033     2 12952
12955 12954  H     16.718608  -11.751787   24.576914     2 12952
12956 12955  O     15.004870  -19.899768   11.797264     1 12956 12957
12957 12956  H     14.353484  -19.375834   12.263550     2 12955
12958 12957  H     14.516544  -20.310179   11.083589     2 12955
12959 12958  O      7.329001  -23.040029   23.541850     1 12959 12960
12960 12959  H      6.466833  -22.714271   23.283434     2 12958
12961 12960  H      7.603758  -23.596264   22.812917     2 12958
12962 12961  O     -1.871982  -15.256773    0.026989     1 12962 12963
12963 12962  H     -1.539341  -15.348796   -0.865823     2 12961
12964 12963  H     -1.925117  -14.311366    0.167043     2 12961
12965 12964  O     16.682112   -6.342060   19.678099     1 12965 12966
12966 12965  H     17.235361   -5.942683   19.006798     2 12964
12967 12966  H     17.095432   -6.097865   20.506209     2 12964
12968 12967  O     22.891713  -12.810862    3.552025     1 12968 12969
12969 12968  H     22.373874  -13.453209    3.066776     2 12967
12970 12969  H     22.277171  -12.433133    4.181223     2 12967
12971 12970  O     -1.276453   11.356306  -27.781036     1 12971 12972
12972 12971  H     -0.730671   10.769265  -28.304233     2 12970
12973 12972  H     -2.173553   11.078341  -27.965914     2 12970
12974 12973  O     14.915529   -8.246410   25.786636     1 12974 12975
12975 12974  H     14.937141   -8.648604   26.654970     2 12973
12976 12975  H     15.663855   -7.649588   25.779898     2 12973
12977 12976  O     18.987023   -0.164829   27.554373     1 12977 12978
12978 12977  H     19.167440   -0.306078   26.625003     2 12976
12979 12978  H     19.849889   -0.043770   27.950654     2 12976
12980 12979  O    -22.165688    6.899563  -22.916635     1 12980 12981
12981 12980  H    -22.838642    7.512269  -22.620062     2 12979
12982 12981  H    -21.591596    6.788373  -22.158818     2 12979
12983 12982  O     22.329449  -19.142044   11.974898     1 12983 12984
12984 12983  H     23.076490  -19.738962   11.931892     2 12982
12985 12984  H     21.765988  -19.410080   11.249020     2 12982
12986 12985  O     15.090638    1.778418   25.585438     1 12986 12987
12987 12986  H     15.180591    1.459944   26.483611     2 12985
12988 12987  H     15.757373    1.299556   25.093110     2 12985
12989 12988  O    -28.998328   16.765351   -8.450260     1 12989 12990
12990 12989  H    -28.996831   16.440027   -9.350479     2 12988
12991 12990  H    -29.908528   16.681234   -8.166197     2 12988
12992 12991  O      0.909096  -15.492370    6.989923     1 12992 12993
12993 12992  H      1.822828  -15.388772    7.255617     2 12991
12994 12993  H      0.769125  -16.439177    6.975875     2 12991
12995 12994  O     -3.628317   20.299650  -16.707258     1 12995 12996
12996 12995  H     -4.205757   20.812995  -16.142218     2 12994
12997 12996  H     -3.509026   20.843423  -17.485920     2 12994
12998 12997  O      3.649282  -18.240808    6.898964     1 12998 12999
12999 12998  H      4.366122  -18.760312    7.262953     2 12997
13000 12999  H      3.889662  -18.109556    5.981782     2 12997
13001 13000  O      3.921293  -25.401586   -4.258696     1 13001 13002
13002 13001  H      3.836651  -25.466300   -5.209948     2 13000
13003 13002  H      4.647276  -24.792627   -4.123234     2 13000
13004 13003  O     25.388446   -8.607895   16.935838     1 13004 13005
13005 13004  H     25.136921   -9.514076   17.114176     2 13003
13006 13005  H     26.130605   -8.678548   16.335471     2 13003
13007 13006  O     22.149998   -1.669156   24.922048     1 13007 13008
13008 13007  H     22.946657   -2.197567   24.970514     2 13006
13009 13008  H     22.415360   -0.805390   25.237836     2 13006
13010 13009  O     20.083997    0.764119   11.017094     1 13010 13011
13011 13010  H     20.877350    0.273097   11.230915     2 13009
13012 13011  H     19.841089    1.196089   11.836014     2 13009
13013 13012  O     24.784280   -9.372523   -0.620490     1 13013 13014
13014 13013  H     24.523539   -8.498178   -0.909915     2 13012
13015 13014  H     24.923646   -9.862038   -1.431159     2 13012
13016 13015  O     20.513246  -14.340548    5.791265     1 13016 13017
13017 13016  H     21.309558  -14.020610    6.215244     2 13015
13018 13017  H     19.805147  -14.071771    6.376575     2 13015
13019 13018  O      6.327672   -8.642305    3.474874     1 13019 13020
13020 13019  H      6.871608   -9.413873    3.633147     2 13018
13021 13020  H      6.627363   -8.001112    4.119302     2 13018
13022 13021  O    -24.584663    9.500968  -18.740252     1 13022 13023
13023 13022  H    -24.872769   10.269936  -19.232101     2 13021
13024 13023  H    -25.390993    9.021040  -18.551220     2 13021
13025 13024  O      6.680379  -12.269237   22.692733     1 13025 13026
13026 13025  H      6.694588  -11.936876   23.590266     2 13024
13027 13026  H      7.444462  -11.869941   22.276835     2 13024
13028 13027  O    -16.648144    5.378547  -27.205071     1 13028 13029
13029 13028  H    -16.408217    5.727310  -26.346565     2 13027
13030 13029  H    -16.200443    5.949277  -27.829622     2 13027
13031 13030  O    -14.968879    8.830963  -22.994010     1 13031 13032
13032 13031  H    -14.066797    9.039195  -22.750864     2 13030
13033 13032  H    -15.272335    8.238857  -22.305857     2 13030
13034 13033  O     27.800809  -14.848611    3.019638     1 13034 13035
13035 13034  H     28.038035  -14.239860    3.719195     2 13033
13036 13035  H     26.914794  -14.589644    2.766369     2 13033
13037 13036  O     24.634413  -11.037467   18.541351     1 13037 13038
13038 13037  H     24.138399  -11.643371   17.990823     2 13036
13039 13038  H     24.528307  -11.378413   19.429455     2 13036
13040 13039  O     29.185822  -10.138056    6.711651     1 13040 13041
13041 13040  H     30.101020   -9.861649    6.759030     2 13039
13042 13041  H     28.927470   -9.958751    5.807586     2 13039
13043 13042  O     25.984439    3.530151   17.675016     1 13043 13044
13044 13043  H     25.944137    2.832992   17.020359     2 13042
13045 13044  H     26.260327    4.304386   17.184427     2 13042
13046 13045  O     35.974320   -4.549818   12.638295     1 13046 13047
13047 13046  H     35.573331   -4.685966   11.779864     2 13045
13048 13047  H     36.734517   -3.995250   12.462839     2 13045
13049 13048  O      3.935145  -18.359200    3.944762     1 13049 13050
13050 13049  H      4.703652  -18.464305    3.383885     2 13048
13051 13050  H      3.843093  -17.412353    4.050766     2 13048
13052 13051  O     25.477115   -4.265048    2.569529     1 13052 13053
13053 13052  H     26.121003   -4.062245    1.890920     2 13051
13054 13053  H     24.716920   -4.592593    2.088854     2 13051
13055 13054  O     23.136983  -27.718542    2.557523     1 13055 13056
13056 13055  H     22.510467  -27.938006    1.867926     2 13054
13057 13056  H     23.566749  -28.548465    2.764310     2 13054
13058 13057  O     -6.055594   30.037957  -18.010739     1 13058 13059
13059 13058  H     -5.362855   29.990595  -18.669602     2 13057
13060 13059  H     -6.868684   30.014198  -18.515270     2 13057
13061 13060  O      0.156559   -9.645977   28.217317     1 13061 13062
13062 13061  H      0.277166   -9.075295   28.976269     2 13060
13063 13062  H      0.269315  -10.531570   28.562633     2 13060
13064 13063  O     31.804137   -9.752700    6.400776     1 13064 13065
13065 13064  H     32.399418   -9.328462    5.782800     2 13063
13066 13065  H     32.253671  -10.559722    6.651507     2 13063
13067 13066  O     34.475459   -9.665407    9.157890     1 13067 13068
13068 13067  H     34.974946  -10.448541    8.926708     2 13066
13069 13068  H     33.609243   -9.995142    9.397006     2 13066
13070 13069  O     16.904212    0.173785   24.191672     1 13070 13071
13071 13070  H     16.717802    0.424933   23.287013     2 13069
13072 13071  H     17.781893   -0.206802   24.159090     2 13069
13073 13072  O     16.758233   -7.697371    6.187502     1 13073 13074
13074 13073  H     16.017397   -7.308520    6.652464     2 13072
13075 13074  H     16.940334   -7.086917    5.473068     2 13072
13076 13075  O      1.140625   -4.302914   21.774441     1 13076 13077
13077 13076  H      0.836310   -5.194813   21.606691     2 13075
13078 13077  H      2.080935   -4.332996   21.597963     2 13075
13079 13078  O      0.978098   -4.426184  -35.659259     1 13079 13080
13080 13079  H      0.248922   -5.038990  -35.754143     2 13078
13081 13080  H      1.301425   -4.573665  -34.770473     2 13078
13082 13081  O     -9.775800    2.728525   35.086910     1 13082 13083
13083 13082  H     -9.796542    2.326060   34.218680     2 13081
13084 13083  H     -8.899768    3.108301   35.154518     2 13081
13085 13084  O     29.369697    0.022689   -0.950957     1 13085 13086
13086 13085  H     28.939797   -0.760903   -1.293596     2 13084
13087 13086  H     30.016073    0.253041   -1.618316     2 13084
13088 13087  O      1.919989  -28.457211    4.029068     1 13088 13089
13089 13088  H      2.717167  -28.475620    3.499539     2 13087
13090 13089  H      1.260733  -28.064686    3.456760     2 13087
13091 13090  O      7.758730  -26.568939    9.151972     1 13091 13092
13092 13091  H      7.618598  -26.576251   10.098830     2 13090
13093 13092  H      6.891428  -26.728587    8.779772     2 13090
13094 13093  O     -6.734306   11.278454  -33.099751     1 13094 13095
13095 13094  H     -6.978430   10.782742  -32.318147     2 13093
13096 13095  H     -7.551089   11.370727  -33.590244     2 13093
13097 13096  O      7.531765  -11.132901    4.283104     1 13097 13098
13098 13097  H      8.440986  -11.328308    4.056470     2 13096
13099 13098  H      7.560074  -10.902678    5.211774     2 13096
13100 13099  O    -35.292517    9.774736   -9.382832     1 13100 13101
13101 13100  H    -36.226802    9.949292   -9.496291     2 13099
13102 13101  H    -35.200592    9.553051   -8.456205     2 13099
13103 13102  O      7.286882  -16.100504   24.838090     1 13103 13104
13104 13103  H      7.248940  -16.397951   25.747111     2 13102
13105 13104  H      6.641778  -15.395032   24.789299     2 13102
13106 13105  O      2.489438  -21.648665    1.239589     1 13106 13107
13107 13106  H      1.607325  -21.733439    1.601421     2 13105
13108 13107  H      3.070270  -21.801961    1.984819     2 13105
13109 13108  O     29.495243    0.474909    2.173956     1 13109 13110
13110 13109  H     30.167152   -0.129716    2.488915     2 13108
13111 13110  H     29.662197    0.551000    1.234506     2 13108
13112 13111  O      7.969953  -23.254653    7.460236     1 13112 13113
13113 13112  H      8.095001  -23.955871    6.820793     2 13111
13114 13113  H      7.201122  -23.522968    7.963364     2 13111
13115 13114  O     15.672638  -13.949819   16.637645     1 13115 13116
13116 13115  H     16.067328  -14.821741   16.623355     2 13114
13117 13116  H     14.797973  -14.088247   17.001005     2 13114
13118 13117  O     23.004351  -18.644842    8.181800     1 13118 13119
13119 13118  H     22.674236  -17.750570    8.268595     2 13117
13120 13119  H     22.534443  -19.140285    8.852586     2 13117
13121 13120  O     22.450689   -7.673452   21.216856     1 13121 13122
13122 13121  H     22.981326   -6.882363   21.310846     2 13120
13123 13122  H     22.347325   -7.782178   20.271485     2 13120
13124 13123  O      3.295430  -20.988635   18.182243     1 13124 13125
13125 13124  H      3.390043  -20.371235   17.456917     2 13123
13126 13125  H      3.615989  -21.820180   17.832950     2 13123
13127 13126  O      5.900342  -24.076946    8.859521     1 13127 13128
13128 13127  H      5.863359  -25.020897    9.013857     2 13126
13129 13128  H      5.771693  -23.687167    9.724249     2 13126
13130 13129  O     23.221501  -28.705943   -0.053309     1 13130 13131
13131 13130  H     22.753637  -29.512964    0.161288     2 13129
13132 13131  H     23.066917  -28.580650   -0.989598     2 13129
13133 13132  O      6.903334  -32.336716    4.219490     1 13133 13134
13134 13133  H      7.630174  -31.715578    4.265579     2 13132
13135 13134  H      6.838638  -32.561976    3.291425     2 13132
13136 13135  O     33.686315   -4.537038   14.037321     1 13136 13137
13137 13136  H     33.346258   -3.670965   13.812576     2 13135
13138 13137  H     34.576232   -4.544319   13.684866     2 13135
13139 13138  O      9.590178   -5.896922   28.777468     1 13139 13140
13140 13139  H      9.032000   -5.237002   29.188779     2 13138
13141 13140  H      9.888828   -5.486577   27.965892     2 13138
13142 13141  O     24.404953   -3.188468   21.917734     1 13142 13143
13143 13142  H     23.882170   -2.411728   21.718726     2 13141
13144 13143  H     25.309137   -2.874370   21.922739     2 13141
13145 13144  O     34.191611   -0.651284   14.787854     1 13145 13146
13146 13145  H     34.780062   -1.189063   15.317713     2 13144
13147 13146  H     33.524179   -1.262191   14.475510     2 13144
13148 13147  O     32.012840   -3.876430    6.303093     1 13148 13149
13149 13148  H     32.498009   -4.698908    6.236975     2 13147
13150 13149  H     31.253591   -3.999196    5.733266     2 13147
13151 13150  O     22.486952   -4.712023    8.647744     1 13151 13152
13152 13151  H     22.730845   -5.576054    8.315783     2 13150
13153 13152  H     22.155308   -4.245104    7.880782     2 13150
13154 13153  O     -1.183907   -9.608809  -34.059207     1 13154 13155
13155 13154  H     -1.312923  -10.533018  -33.846079     2 13153
13156 13155  H     -0.525764   -9.307674  -33.432791     2 13153
13157 13156  O     15.880706    3.128124   21.707711     1 13157 13158
13158 13157  H     15.861363    3.508952   20.829743     2 13156
13159 13158  H     16.309992    2.280420   21.592198     2 13156
13160 13159  O     17.302118    3.202725   24.471223     1 13160 13161
13161 13160  H     17.731777    2.429160   24.106227     2 13159
13162 13161  H     16.898469    3.631533   23.716622     2 13159
13163 13162  O     27.701719    0.875530    5.563292     1 13163 13164
13164 13163  H     27.903673    1.391843    4.782992     2 13162
13165 13164  H     28.275409    1.231593    6.241768     2 13162
13166 13165  O    -22.827321   21.679333   -7.876591     1 13166 13167
13167 13166  H    -22.043749   21.233332   -8.198040     2 13165
13168 13167  H    -23.489089   21.516115   -8.548643     2 13165
13169 13168  O     23.458651  -12.976564   16.957287     1 13169 13170
13170 13169  H     22.831528  -13.543460   16.508313     2 13168
13171 13170  H     24.060686  -12.692577   16.269438     2 13168
13172 13171  O     18.888498  -30.072622   -2.473360     1 13172 13173
13173 13172  H     18.734753  -29.368954   -1.842928     2 13171
13174 13173  H     19.391499  -29.660090   -3.175527     2 13171
13175 13174  O     24.432136   -2.927411    4.844917     1 13175 13176
13176 13175  H     24.458490   -1.976248    4.740874     2 13174
13177 13176  H     25.026103   -3.259038    4.171525     2 13174
13178 13177  O     -0.866858  -19.092657    0.397445     1 13178 13179
13179 13178  H     -1.149741  -18.380811    0.971453     2 13177
13180 13179  H     -0.232948  -19.584426    0.919512     2 13177
13181 13180  O     28.137810  -22.263223    0.723174     1 13181 13182
13182 13181  H     28.851922  -22.369861    1.351590     2 13180
13183 13182  H     28.229279  -21.364687    0.406160     2 13180
13184 13183  O     19.903627   -3.750794   19.404473     1 13184 13185
13185 13184  H     20.102446   -3.278784   18.595826     2 13183
13186 13185  H     20.708700   -3.694746   19.919204     2 13183
13187 13186  O      9.287819  -16.233696   22.272137     1 13187 13188
13188 13187  H      9.019673  -16.359137   21.361866     2 13186
13189 13188  H      9.540728  -17.107373   22.570394     2 13186
13190 13189  O     13.365990  -12.468361    2.621987     1 13190 13191
13191 13190  H     13.249969  -11.870168    1.883789     2 13189
13192 13191  H     14.089444  -12.092814    3.123791     2 13189
13193 13192  O     24.609805  -14.266745    8.066631     1 13193 13194
13194 13193  H     24.380479  -13.339043    8.011755     2 13192
13195 13194  H     24.128681  -14.675844    7.347333     2 13192
13196 13195  O     25.292245   -6.959107    9.986482     1 13196 13197
13197 13196  H     25.526149   -7.670365    9.390133     2 13195
13198 13197  H     26.113461   -6.731628   10.422477     2 13195
13199 13198  O     21.901193   -7.819038    9.933297     1 13199 13200
13200 13199  H     22.107334   -7.546195    9.039264     2 13198
13201 13200  H     22.477408   -8.566044   10.095128     2 13198
13202 13201  O    -10.876854   11.882409  -25.959211     1 13202 13203
13203 13202  H    -10.860954   11.038928  -26.411448     2 13201
13204 13203  H    -11.602122   12.358139  -26.364055     2 13201
13205 13204  O    -34.112022    8.936927   -7.042919     1 13205 13206
13206 13205  H    -33.559691    8.442816   -6.437100     2 13204
13207 13206  H    -33.977193    9.852468   -6.798304     2 13204
13208 13207  O     16.294303  -25.204657   12.496055     1 13208 13209
13209 13208  H     15.566190  -24.860404   13.013329     2 13207
13210 13209  H     16.021836  -26.090909   12.258254     2 13207
13211 13210  O     21.587901   -5.165238   -0.701918     1 13211 13212
13212 13211  H     21.280451   -5.740449   -1.402516     2 13210
13213 13212  H     22.195590   -4.564803   -1.133686     2 13210
13214 13213  O     28.041477   -9.965448   12.488310     1 13214 13215
13215 13214  H     28.672998   -9.686014   11.825490     2 13213
13216 13215  H     28.107757  -10.920323   12.495474     2 13213
13217 13216  O     19.747946   -7.499655   11.938551     1 13217 13218
13218 13217  H     19.083160   -8.142485   11.691444     2 13216
13219 13218  H     20.574566   -7.885933   11.649208     2 13216
13220 13219  O      3.098734  -18.700235   30.666689     1 13220 13221
13221 13220  H      3.518448  -19.449482   31.089420     2 13219
13222 13221  H      3.016091  -18.047619   31.362027     2 13219
13223 13222  O      4.502227  -12.048345  -34.767683     1 13223 13224
13224 13223  H      3.646491  -11.637773  -34.643668     2 13222
13225 13224  H      5.130491  -11.383682  -34.485304     2 13222
13226 13225  O     32.849013   -1.120396    5.894044     1 13226 13227
13227 13226  H     32.784938   -2.068687    6.007491     2 13225
13228 13227  H     32.774308   -0.767056    6.780499     2 13225
13229 13228  O      3.880691  -27.987389   -0.230111     1 13229 13230
13230 13229  H      4.547335  -27.464760   -0.675842     2 13228
13231 13230  H      3.947402  -27.728217    0.688916     2 13228
13232 13231  O     22.251160  -19.016025    5.310078     1 13232 13233
13233 13232  H     22.396167  -19.159123    6.245347     2 13231
13234 13233  H     21.453616  -19.507247    5.112959     2 13231
13235 13234  O     31.351703  -17.457107   -2.600953     1 13235 13236
13236 13235  H     30.965219  -17.463859   -1.725273     2 13234
13237 13236  H     31.384211  -16.531272   -2.841795     2 13234
13238 13237  O     -3.793324  -22.241292   13.631813     1 13238 13239
13239 13238  H     -3.714416  -22.702394   14.466911     2 13237
13240 13239  H     -4.399093  -22.776069   13.118696     2 13237
13241 13240  O    -24.469172   22.318826   -5.844175     1 13241 13242
13242 13241  H    -23.926663   22.074483   -6.593984     2 13240
13243 13242  H    -25.367182   22.271655   -6.172175     2 13240
13244 13243  O     28.428267   -5.313673    1.270273     1 13244 13245
13245 13244  H     28.203992   -6.022425    1.873268     2 13243
13246 13245  H     29.175984   -5.647749    0.774749     2 13243
13247 13246  O     -2.767878   24.580030  -23.699363     1 13247 13248
13248 13247  H     -3.513692   25.167423  -23.577043     2 13246
13249 13248  H     -2.118990   25.109395  -24.162990     2 13246
13250 13249  O     14.408149   -6.076712    6.842883     1 13250 13251
13251 13250  H     14.522221   -5.987365    7.789053     2 13249
13252 13251  H     14.565801   -5.197793    6.498095     2 13249
13253 13252  O    -17.624565   31.343898   -4.470221     1 13253 13254
13254 13253  H    -18.425980   31.417637   -3.952024     2 13252
13255 13254  H    -17.456635   32.233729   -4.780431     2 13252
13256 13255  O     31.970318   -9.657660   12.561761     1 13256 13257
13257 13256  H     31.981657   -9.319683   11.666287     2 13255
13258 13257  H     31.598793   -8.945506   13.082373     2 13255
13259 13258  O     33.991388  -13.953521   -1.861999     1 13259 13260
13260 13259  H     33.121456  -14.145470   -2.212150     2 13258
13261 13260  H     34.469561  -14.778909   -1.941477     2 13258
13262 13261  O     17.210367  -14.053109   22.173277     1 13262 13263
13263 13262  H     16.776140  -13.321314   21.734923     2 13261
13264 13263  H     18.069135  -14.108518   21.754135     2 13261
13265 13264  O    -17.014513   10.316309  -23.607852     1 13265 13266
13266 13265  H    -16.171083    9.954248  -23.336248     2 13264
13267 13266  H    -17.650670    9.637236  -23.383362     2 13264
13268 13267  O     -0.192236    0.195235    2.936390     1 13268 13269
13269 13268  H     -0.078521   -0.113479    3.835276     2 13267
13270 13269  H     -0.382258   -0.596416    2.432989     2 13267
13271 13270  O      4.611717  -25.136143   17.851163     1 13271 13272
13272 13271  H      4.428836  -24.413727   17.250413     2 13270
13273 13272  H      4.600289  -24.734537   18.719964     2 13270
13274 13273  O      1.298605  -33.982250    6.733233     1 13274 13275
13275 13274  H      1.331624  -33.297072    6.065646     2 13273
13276 13275  H      1.937033  -34.632880    6.441134     2 13273
13277 13276  O     14.829356   -3.874153    4.927474     1 13277 13278
13278 13277  H     14.489099   -4.297500    4.139290     2 13276
13279 13278  H     15.780714   -3.914535    4.829915     2 13276
13280 13279  O    -27.705364    6.607688  -15.204115     1 13280 13281
13281 13280  H    -28.509009    6.614916  -14.684178     2 13279
13282 13281  H    -27.039149    6.259810  -14.611351     2 13279
13283 13282  O     14.451323  -10.761906    4.907660     1 13283 13284
13284 13283  H     15.165506  -10.865481    5.536505     2 13282
13285 13284  H     13.923977  -10.044680    5.259404     2 13282
13286 13285  O      0.972258  -22.768867   28.583033     1 13286 13287
13287 13286  H      0.986134  -22.195539   27.816657     2 13285
13288 13287  H      0.212977  -23.335228   28.445334     2 13285
13289 13288  O     24.510675  -14.144246   13.054400     1 13289 13290
13290 13289  H     24.689783  -14.656312   12.265768     2 13288
13291 13290  H     23.704770  -13.668373   12.853664     2 13288
13292 13291  O     20.885139   -2.154653    9.163603     1 13292 13293
13293 13292  H     21.491157   -2.460929    9.838265     2 13291
13294 13293  H     20.094974   -1.908613    9.644576     2 13291
13295 13294  O     -2.798647   34.842287  -15.093480     1 13295 13296
13296 13295  H     -3.241968   34.038255  -14.822867     2 13294
13297 13296  H     -3.442672   35.301722  -15.632352     2 13294
13298 13297  O      6.830331  -34.906079    0.207486     1 13298 13299
13299 13298  H      6.217944  -34.828956   -0.524133     2 13297
13300 13299  H      7.689322  -34.990156   -0.206395     2 13297
13301 13300  O     24.553842   -3.229511   25.090025     1 13301 13302
13302 13301  H     24.276411   -3.963716   25.637936     2 13300
13303 13302  H     24.497465   -3.563451   24.194739     2 13300
13304 13303  O     14.023741   -0.526959   32.300012     1 13304 13305
13305 13304  H     13.091628   -0.732008   32.226861     2 13303
13306 13305  H     14.123690   -0.176815   33.185247     2 13303
13307 13306  O      7.291794   -3.529909   35.384584     1 13307 13308
13308 13307  H      7.905765   -3.921194   36.006009     2 13306
13309 13308  H      6.738515   -2.960991   35.919790     2 13306
13310 13309  O     21.535270   -8.036383   14.296833     1 13310 13311
13311 13310  H     21.837877   -7.447250   14.987906     2 13309
13312 13311  H     22.220099   -7.995085   13.629348     2 13309
13313 13312  O      2.085947  -25.383382   20.208947     1 13313 13314
13314 13313  H      1.538323  -26.062932   20.602076     2 13312
13315 13314  H      1.624631  -25.137455   19.407113     2 13312
13316 13315  O      7.172497  -20.790810   25.292574     1 13316 13317
13317 13316  H      7.633006  -19.999555   25.013146     2 13315
13318 13317  H      7.488937  -21.474018   24.701538     2 13315
13319 13318  O    -14.320037   25.261224   -9.839635     1 13319 13320
13320 13319  H    -15.208282   24.919956   -9.735771     2 13318
13321 13320  H    -14.057355   24.983559  -10.717207     2 13318
13322 13321  O     17.073899   -1.855441   30.267261     1 13322 13323
13323 13322  H     16.129708   -1.888523   30.113503     2 13321
13324 13323  H     17.433469   -2.537447   29.699979     2 13321
13325 13324  O     22.231634    0.381417    1.462244     1 13325 13326
13326 13325  H     22.130786    0.131346    2.380680     2 13324
13327 13326  H     21.824466    1.245654    1.402733     2 13324
13328 13327  O    -22.405826   16.339036  -12.394412     1 13328 13329
13329 13328  H    -21.540477   16.025000  -12.132145     2 13327
13330 13329  H    -22.683744   15.731919  -13.080270     2 13327
13331 13330  O     12.788962  -12.815483    6.184776     1 13331 13332
13332 13331  H     13.316768  -12.323870    5.555515     2 13330
13333 13332  H     12.210099  -12.160977    6.575635     2 13330
13334 13333  O      4.422827  -14.546708   31.182628     1 13334 13335
13335 13334  H      4.778661  -14.326913   30.321638     2 13333
13336 13335  H      5.190268  -14.768333   31.710027     2 13333
13337 13336  O      3.455262  -15.416259    7.809306     1 13337 13338
13338 13337  H      3.834960  -14.538972    7.858601     2 13336
13339 13338  H      4.187378  -16.005234    7.991916     2 13336
13340 13339  O     -0.011152   -0.929812    5.675062     1 13340 13341
13341 13340  H      0.889817   -1.180035    5.879695     2 13339
13342 13341  H     -0.420308   -0.787020    6.528545     2 13339
13343 13342  O     10.235545  -16.563472   12.099492     1 13343 13344
13344 13343  H      9.503314  -15.966731   12.254311     2 13342
13345 13344  H     11.006631  -15.996725   12.078154     2 13342
13346 13345  O      4.223964  -10.743586    7.380881     1 13346 13347
13347 13346  H      3.359051  -10.693641    7.787897     2 13345
13348 13347  H      4.071381  -10.514418    6.464129     2 13345
13349 13348  O     23.442470   -3.684819   -2.017154     1 13349 13350
13350 13349  H     23.509499   -3.919304   -2.942765     2 13348
13351 13350  H     23.609831   -2.742612   -1.995547     2 13348
13352 13351  O     18.337223  -22.648358    3.100057     1 13352 13353
13353 13352  H     17.810433  -23.266582    2.593577     2 13351
13354 13353  H     19.085884  -23.162455    3.402451     2 13351
13355 13354  O      8.892205   -3.579548    6.994179     1 13355 13356
13356 13355  H      8.038808   -3.942118    7.231851     2 13354
13357 13356  H      9.308174   -3.375927    7.831879     2 13354
13358 13357  O     27.715879  -11.785578   -6.935066     1 13358 13359
13359 13358  H     27.775351  -12.732480   -6.808294     2 13357
13360 13359  H     27.222979  -11.682930   -7.749158     2 13357
13361 13360  O     18.478032  -13.605911   10.033057     1 13361 13362
13362 13361  H     18.614607  -13.577359   10.980033     2 13360
13363 13362  H     17.669671  -13.113018    9.892201     2 13360
13364 13363  O      6.142090   -3.932725    9.018036     1 13364 13365
13365 13364  H      6.893721   -3.981770    9.608694     2 13363
13366 13365  H      5.497886   -4.529236    9.399360     2 13363
13367 13366  O     10.358713   -8.028766  -36.041704     1 13367 13368
13368 13367  H      9.873972   -8.597276  -35.443327     2 13366
13369 13368  H     10.567199   -8.589190  -36.789160     2 13366
13370 13369  O     20.321084  -10.462168   13.076911     1 13370 13371
13371 13370  H     20.293625   -9.720810   13.681780     2 13369
13372 13371  H     21.036394  -11.009667   13.400649     2 13369
13373 13372  O      9.587449  -30.681695   10.202822     1 13373 13374
13374 13373  H      9.336981  -29.844180   10.592780     2 13372
13375 13374  H      9.983229  -30.446825    9.363521     2 13372
13376 13375  O    -17.933060   16.485316  -18.902463     1 13376 13377
13377 13376  H    -17.414109   17.032240  -18.312722     2 13375
13378 13377  H    -18.841490   16.670659  -18.664483     2 13375
13379 13378  O     12.429456   -4.989367   21.706331     1 13379 13380
13380 13379  H     12.208196   -5.153672   20.789664     2 13378
13381 13380  H     12.664469   -5.849519   22.054379     2 13378
13382 13381  O      9.632842   -2.559421   27.134143     1 13382 13383
13383 13382  H     10.348278   -3.183227   27.010654     2 13381
13384 13383  H     10.017010   -1.708654   26.922384     2 13381
13385 13384  O      0.701866  -10.622101   -1.265343     1 13385 13386
13386 13385  H      1.509930  -10.166902   -1.028579     2 13384
13387 13386  H      0.941416  -11.548821   -1.271449     2 13384
13388 13387  O     25.105790   -6.433782    4.904728     1 13388 13389
13389 13388  H     25.101196   -7.196908    4.326931     2 13387
13390 13389  H     24.910286   -5.695094    4.328230     2 13387
13391 13390  O     17.568711  -12.337421   15.151838     1 13391 13392
13392 13391  H     18.083635  -11.775683   15.731092     2 13390
13393 13392  H     16.914719  -12.737707   15.724810     2 13390
13394 13393  O     11.519583  -21.514001   19.013070     1 13394 13395
13395 13394  H     12.403681  -21.844537   18.853855     2 13393
13396 13395  H     11.636554  -20.817227   19.658868     2 13393
13397 13396  O     16.877142  -15.632469   13.169122     1 13397 13398
13398 13397  H     16.143719  -16.241196   13.257289     2 13396
13399 13398  H     17.460991  -15.853448   13.894738     2 13396
13400 13399  O     18.818380   -5.453786    1.682892     1 13400 13401
13401 13400  H     17.939264   -5.814565    1.567891     2 13399
13402 13401  H     18.672530   -4.564760    2.006302     2 13399
13403 13402  O      7.334642  -11.434697   13.799138     1 13403 13404
13404 13403  H      7.370943  -10.717258   13.166527     2 13402
13405 13404  H      6.804922  -11.092947   14.519440     2 13402
13406 13405  O      2.934282  -11.335065    0.882331     1 13406 13407
13407 13406  H      3.653837  -10.707675    0.952002     2 13405
13408 13407  H      2.458348  -11.247067    1.708150     2 13405
13409 13408  O     10.882539  -13.198440    9.679922     1 13409 13410
13410 13409  H     10.373688  -12.675836   10.299750     2 13408
13411 13410  H     11.472439  -13.714893   10.229035     2 13408
13412 13411  O     34.302327   -4.937621    3.696214     1 13412 13413
13413 13412  H     33.629906   -4.291955    3.478967     2 13411
13414 13413  H     33.867550   -5.783243    3.586105     2 13411
13415 13414  O     -2.992340  -14.817083   -8.142781     1 13415 13416
13416 13415  H     -2.361748  -15.299281   -8.677636     2 13414
13417 13416  H     -2.485867  -14.098665   -7.763846     2 13414
13418 13417  O     30.188990   -0.436783   11.848263     1 13418 13419
13419 13418  H     29.320026   -0.122735   12.098276     2 13417
13420 13419  H     30.255225   -0.240941   10.913656     2 13417
13421 13420  O     13.156353   -9.390798   13.541466     1 13421 13422
13422 13421  H     13.824943   -9.790963   12.985511     2 13420
13423 13422  H     13.491814   -9.493561   14.432048     2 13420
13424 13423  O      2.323309  -12.750142   -1.192063     1 13424 13425
13425 13424  H      2.634305  -12.185494   -0.484472     2 13423
13426 13425  H      2.351776  -13.633440   -0.824360     2 13423
13427 13426  O     -2.000097  -13.756183   21.644778     1 13427 13428
13428 13427  H     -2.346163  -14.039777   20.798585     2 13426
13429 13428  H     -1.190804  -13.292414   21.429844     2 13426
13430 13429  O      4.543101  -10.522334   32.790629     1 13430 13431
13431 13430  H      3.705117  -10.922004   32.557653     2 13429
13432 13431  H      5.196841  -11.180147   32.553695     2 13429
13433 13432  O     11.866766  -15.793085   20.813631     1 13433 13434
13434 13433  H     11.777688  -14.841779   20.756078     2 13432
13435 13434  H     11.211319  -16.056864   21.459419     2 13432
13436 13435  O      9.793642  -18.407006   19.793408     1 13436 13437
13437 13436  H     10.495969  -18.435874   20.443127     2 13435
13438 13437  H      9.056505  -18.846684   20.217134     2 13435
13439 13438  O     10.527296  -25.227597   10.134986     1 13439 13440
13440 13439  H      9.608739  -25.149318    9.877391     2 13438
13441 13440  H     10.870403  -25.934560    9.588438     2 13438
13442 13441  O     15.058564  -15.256099   10.317130     1 13442 13443
13443 13442  H     14.430932  -15.427640    9.615074     2 13441
13444 13443  H     15.493761  -16.096485   10.460612     2 13441
13445 13444  O      5.929347  -29.901130    9.573299     1 13445 13446
13446 13445  H      5.642395  -29.014647    9.354125     2 13444
13447 13446  H      6.338777  -29.814879   10.434205     2 13444
13448 13447  O     11.522937  -18.091308   15.469810     1 13448 13449
13449 13448  H     11.213787  -17.205008   15.657237     2 13447
13450 13449  H     10.951913  -18.659102   15.987279     2 13447
13451 13450  O     15.549493   -0.954912   15.645420     1 13451 13452
13452 13451  H     15.360868   -1.510675   14.889258     2 13450
13453 13452  H     15.790800   -1.568091   16.339692     2 13450
13454 13453  O     16.251608  -17.768600   10.674469     1 13454 13455
13455 13454  H     17.163270  -17.614335   10.922068     2 13453
13456 13455  H     16.037936  -18.617272   11.062196     2 13453
13457 13456  O     13.752122   -1.283439   25.064478     1 13457 13458
13458 13457  H     14.040332   -0.825936   25.854325     2 13456
13459 13458  H     13.585314   -2.180405   25.354059     2 13456
13460 13459  O     33.968309   -7.019542    9.057884     1 13460 13461
13461 13460  H     33.503533   -7.131733    8.228651     2 13459
13462 13461  H     34.355624   -7.877016    9.233832     2 13459
13463 13462  O     -0.265846  -21.877338   -3.160744     1 13463 13464
13464 13463  H     -1.098311  -21.586059   -3.532753     2 13462
13465 13464  H      0.129253  -21.081650   -2.804361     2 13462
13466 13465  O      4.364036  -27.514865   19.195441     1 13466 13467
13467 13466  H      4.287407  -26.782562   18.583809     2 13465
13468 13467  H      3.948458  -27.201192   19.998645     2 13465
13469 13468  O      7.731156  -10.871452   -2.834848     1 13469 13470
13470 13469  H      6.808504  -10.779079   -2.597335     2 13468
13471 13470  H      8.203218  -10.767487   -2.008665     2 13468
13472 13471  O      7.808443  -12.966987   26.197376     1 13472 13473
13473 13472  H      7.206842  -12.804400   26.923925     2 13471
13474 13473  H      7.666903  -12.232824   25.599712     2 13471
13475 13474  O    -20.174525   28.355233   -5.293408     1 13475 13476
13476 13475  H    -20.516802   28.000760   -4.472782     2 13474
13477 13476  H    -19.260789   28.565905   -5.101223     2 13474
13478 13477  O     17.257596  -20.023666    4.912328     1 13478 13479
13479 13478  H     16.589533  -20.706774    4.854992     2 13477
13480 13479  H     17.376952  -19.882948    5.851575     2 13477
13481 13480  O     24.186859    0.970124    6.405505     1 13481 13482
13482 13481  H     24.049008    1.669688    5.766882     2 13480
13483 13482  H     23.312256    0.778338    6.743912     2 13480
13484 13483  O     28.009250   -9.709703   -3.161995     1 13484 13485
13485 13484  H     27.122046  -10.066572   -3.120221     2 13483
13486 13485  H     27.967227   -8.901668   -2.650580     2 13483
13487 13486  O     14.205118  -29.868205    7.514908     1 13487 13488
13488 13487  H     14.819806  -29.194170    7.224966     2 13486
13489 13488  H     14.726410  -30.670337    7.547612     2 13486
13490 13489  O     18.066831  -23.553481   11.678476     1 13490 13491
13491 13490  H     17.367073  -24.087327   12.054744     2 13489
13492 13491  H     18.817535  -24.144926   11.624934     2 13489
13493 13492  O      4.538798  -15.007085   17.766970     1 13493 13494
13494 13493  H      3.889180  -14.813060   18.442678     2 13492
13495 13494  H      4.627626  -15.959964   17.786018     2 13492
13496 13495  O     22.079310   -3.082468   17.725221     1 13496 13497
13497 13496  H     22.837086   -2.686569   17.294791     2 13495
13498 13497  H     22.416739   -3.396495   18.564125     2 13495
13499 13498  O      6.356498  -14.605792   28.716173     1 13499 13500
13500 13499  H      7.295515  -14.787075   28.756363     2 13498
13501 13500  H      5.977806  -15.388794   28.316509     2 13498
13502 13501  O      6.638257  -18.863243    3.353405     1 13502 13503
13503 13502  H      6.822361  -19.802558    3.348343     2 13501
13504 13503  H      7.266129  -18.498987    3.977366     2 13501
13505 13504  O      5.996216  -19.314054   17.378221     1 13505 13506
13506 13505  H      6.320708  -19.495250   16.496119     2 13504
13507 13506  H      6.230652  -20.091756   17.884631     2 13504
13508 13507  O    -15.636805   -0.436124  -32.039018     1 13508 13509
13509 13508  H    -15.956677   -0.086314  -32.870610     2 13507
13510 13509  H    -15.918304    0.203889  -31.385281     2 13507
13511 13510  O     11.785229   -3.587078   24.196097     1 13511 13512
13512 13511  H     11.606037   -4.195674   23.479345     2 13510
13513 13512  H     11.611457   -2.721860   23.825378     2 13510
13514 13513  O      7.572630  -14.362217   15.931976     1 13514 13515
13515 13514  H      6.810070  -13.860003   15.644721     2 13513
13516 13515  H      7.204230  -15.147714   16.336336     2 13513
13517 13516  O    -17.466235   19.223078  -10.745055     1 13517 13518
13518 13517  H    -17.757191   18.784907   -9.945316     2 13516
13519 13518  H    -17.580842   20.155784  -10.562967     2 13516
13520 13519  O     -0.534605   14.023941  -28.526446     1 13520 13521
13521 13520  H     -0.912779   13.173824  -28.301685     2 13519
13522 13521  H      0.265010   14.076856  -28.002952     2 13519
13523 13522  O      8.151871  -13.554934   30.870187     1 13523 13524
13524 13523  H      8.324966  -14.113241   30.112188     2 13522
13525 13524  H      8.590837  -12.729344   30.665392     2 13522
13526 13525  O     10.102455  -12.906083    3.576532     1 13526 13527
13527 13526  H     10.873187  -13.473148    3.601837     2 13525
13528 13527  H      9.746716  -12.944876    4.464325     2 13525
13529 13528  O     24.913036    1.358161    2.033768     1 13529 13530
13530 13529  H     24.246404    1.332096    1.347361     2 13528
13531 13530  H     25.735919    1.494168    1.564091     2 13528
13532 13531  O     30.458548   -6.997396   10.310465     1 13532 13533
13533 13532  H     30.971808   -6.395075   10.848987     2 13531
13534 13533  H     30.885513   -6.976877    9.454012     2 13531
13535 13534  O      9.837942   -8.893602    8.319224     1 13535 13536
13536 13535  H     10.329425   -9.660724    8.025625     2 13534
13537 13536  H      8.919567   -9.145455    8.222329     2 13534
13538 13537  O     12.578127   -5.329739    9.980302     1 13538 13539
13539 13538  H     13.395477   -5.762313   10.227385     2 13537
13540 13539  H     12.179709   -5.917929    9.338798     2 13537
13541 13540  O      1.063172   -9.601078   18.658648     1 13541 13542
13542 13541  H      1.194765  -10.473485   19.029890     2 13540
13543 13542  H      1.718023   -9.054279   19.092711     2 13540
13544 13543  O     18.955579   -5.064891   27.563806     1 13544 13545
13545 13544  H     19.792391   -5.028847   28.027139     2 13543
13546 13545  H     18.550672   -4.214238   27.733131     2 13543
13547 13546  O     -5.266617  -19.881513    4.092936     1 13547 13548
13548 13547  H     -4.645811  -19.776714    4.813941     2 13546
13549 13548  H     -5.311364  -19.015795    3.687027     2 13546
13550 13549  O     27.585490  -11.059845    8.680264     1 13550 13551
13551 13550  H     28.154396  -10.700475    9.361021     2 13549
13552 13551  H     28.032638  -10.852540    7.859706     2 13549
13553 13552  O     24.511959   -5.921295   20.863826     1 13553 13554
13554 13553  H     24.635427   -5.039796   21.215887     2 13552
13555 13554  H     25.322180   -6.105589   20.388631     2 13552
13556 13555  O     12.364230  -14.594276   25.749804     1 13556 13557
13557 13556  H     12.821283  -15.281784   25.265378     2 13555
13558 13557  H     11.631841  -14.348732   25.184521     2 13555
13559 13558  O     14.660702   -4.220606   23.619668     1 13559 13560
13560 13559  H     14.353628   -4.222568   22.713063     2 13558
13561 13560  H     13.992459   -4.709008   24.100445     2 13558
13562 13561  O     19.531797  -19.598538   14.894989     1 13562 13563
13563 13562  H     18.755645  -19.565606   14.335762     2 13561
13564 13563  H     19.194340  -19.829134   15.760541     2 13561
13565 13564  O      2.432568  -27.734082    6.518329     1 13565 13566
13566 13565  H      2.423503  -28.104710    5.635841     2 13564
13567 13566  H      1.568883  -27.334026    6.619491     2 13564
13568 13567  O    -26.110906   -0.543353  -23.454518     1 13568 13569
13569 13568  H    -26.276674   -0.844488  -22.561171     2 13567
13570 13569  H    -26.978012   -0.498520  -23.857445     2 13567
13571 13570  O      6.965073  -17.965090    6.701323     1 13571 13572
13572 13571  H      6.851468  -18.912851    6.630080     2 13570
13573 13572  H      7.898697  -17.847821    6.876895     2 13570
13574 13573  O     11.300032  -29.172798    3.812366     1 13574 13575
13575 13574  H     11.666469  -29.948689    4.236571     2 13573
13576 13575  H     11.563267  -29.253621    2.895629     2 13573
13577 13576  O    -18.797784   24.135563   -8.183426     1 13577 13578
13578 13577  H    -19.743393   24.262777   -8.106802     2 13576
13579 13578  H    -18.458906   24.321301   -7.307701     2 13576
13580 13579  O    -18.151478   27.353618   -3.350573     1 13580 13581
13581 13580  H    -18.394365   27.305220   -2.425968     2 13579
13582 13581  H    -17.446656   28.000605   -3.380003     2 13579
13583 13582  O     27.400109  -15.354591   10.853139     1 13583 13584
13584 13583  H     26.447574  -15.263949   10.826839     2 13582
13585 13584  H     27.548825  -16.207850   11.260650     2 13582
13586 13585  O     14.309347  -18.435490   -3.899416     1 13586 13587
13587 13586  H     13.661790  -18.756473   -4.527007     2 13585
13588 13587  H     13.928547  -18.627229   -3.042409     2 13585
13589 13588  O    -27.815668    7.244608  -11.452379     1 13589 13590
13590 13589  H    -27.285734    7.976662  -11.136946     2 13588
13591 13590  H    -27.225935    6.491228  -11.422961     2 13588
13592 13591  O     13.957963   32.379826    0.560825     1 13592 13593
13593 13592  H     13.075285   32.085971    0.335524     2 13591
13594 13593  H     14.360573   31.624143    0.988704     2 13591
13595 13594  O     26.638715    0.865906   24.179510     1 13595 13596
13596 13595  H     27.147317    0.314411   24.773991     2 13594
13597 13596  H     27.254081    1.540586   23.892520     2 13594
13598 13597  O      8.507454   -6.691013   33.727264     1 13598 13599
13599 13598  H      7.863011   -6.059808   33.407102     2 13597
13600 13599  H      8.977449   -6.224515   34.418434     2 13597
13601 13600  O     15.568367  -13.038764   13.482067     1 13601 13602
13602 13601  H     15.483164  -13.873020   13.943573     2 13600
13603 13602  H     16.311902  -12.606765   13.902501     2 13600
13604 13603  O      5.581033   -1.684878   12.213598     1 13604 13605
13605 13604  H      6.483045   -1.396691   12.073765     2 13603
13606 13605  H      5.079185   -1.243819   11.528144     2 13603
13607 13606  O      5.984668  -17.033209   27.302291     1 13607 13608
13608 13607  H      5.049698  -17.118153   27.115615     2 13606
13609 13608  H      6.248391  -17.901424   27.607058     2 13606
13610 13609  O      1.867307  -26.299432   14.716238     1 13610 13611
13611 13610  H      1.577977  -25.390099   14.641184     2 13609
13612 13611  H      1.325530  -26.666790   15.414634     2 13609
13613 13612  O     10.335561   -9.901097   27.052122     1 13613 13614
13614 13613  H     10.501573   -9.383637   26.264145     2 13612
13615 13614  H      9.918820   -9.288486   27.658147     2 13612
13616 13615  O     27.440933  -12.230680   -0.037557     1 13616 13617
13617 13616  H     26.663859  -12.614032   -0.444288     2 13615
13618 13617  H     27.251743  -11.293339    0.005222     2 13615
13619 13618  O    -22.737547   18.562894   -9.095971     1 13619 13620
13620 13619  H    -23.539435   18.392523   -9.590116     2 13618
13621 13620  H    -22.300695   19.262775   -9.581315     2 13618
13622 13621  O     28.270448   -9.569792    3.887543     1 13622 13623
13623 13622  H     28.877460  -10.293382    3.732030     2 13621
13624 13623  H     27.654618   -9.611704    3.155950     2 13621
13625 13624  O    -16.127800  -32.589953   -2.208515     1 13625 13626
13626 13625  H    -16.537286  -33.422615   -2.443519     2 13624
13627 13626  H    -16.814656  -31.937555   -2.345760     2 13624
13628 13627  O      3.714275  -18.722732   27.904599     1 13628 13629
13629 13628  H      3.574160  -19.024306   28.802181     2 13627
13630 13629  H      3.716053  -19.523343   27.379956     2 13627
13631 13630  O      5.980908  -10.863221   -7.011295     1 13631 13632
13632 13631  H      6.404072  -10.153045   -6.528788     2 13630
13633 13632  H      5.682610  -10.456287   -7.824717     2 13630
13634 13633  O      2.031759  -15.435370   -0.752046     1 13634 13635
13635 13634  H      1.245055  -15.394028   -1.295755     2 13633
13636 13635  H      1.987384  -16.293652   -0.330602     2 13633
13637 13636  O     24.051387   -7.519629   12.441651     1 13637 13638
13638 13637  H     24.552199   -8.332019   12.367888     2 13636
13639 13638  H     23.963367   -7.209297   11.540442     2 13636
13640 13639  O     20.074880  -11.602351   20.163323     1 13640 13641
13641 13640  H     20.003074  -12.215690   20.894685     2 13639
13642 13641  H     21.016658  -11.476998   20.046819     2 13639
13643 13642  O     10.638633   -3.747568   11.588411     1 13643 13644
13644 13643  H     11.450176   -4.196913   11.352362     2 13642
13645 13644  H     10.917157   -3.036421   12.165409     2 13642
13646 13645  O      9.283686  -17.820447    3.800028     1 13646 13647
13647 13646  H      9.549311  -18.568031    3.264497     2 13645
13648 13647  H     10.002011  -17.703299    4.421733     2 13645
13649 13648  O     10.471565   -0.576745   29.441949     1 13649 13650
13650 13649  H      9.586773   -0.273458   29.238503     2 13648
13651 13650  H     10.501589   -1.472329   29.105408     2 13648
13652 13651  O     14.593667   -4.722908   26.848281     1 13652 13653
13653 13652  H     15.155104   -4.984271   26.118411     2 13651
13654 13653  H     15.084778   -4.973815   27.630641     2 13651
13655 13654  O    -14.161303   17.190649  -10.833111     1 13655 13656
13656 13655  H    -13.383391   17.439415  -11.332310     2 13654
13657 13656  H    -14.885468   17.292336  -11.450749     2 13654
13658 13657  O      6.916692   -3.839434   28.322454     1 13658 13659
13659 13658  H      6.783742   -3.888620   29.269098     2 13657
13660 13659  H      7.762301   -3.402474   28.221253     2 13657
13661 13660  O     10.707829  -26.207665   12.759142     1 13661 13662
13662 13661  H     10.595199  -25.683837   11.965952     2 13660
13663 13662  H     10.840014  -25.563933   13.455107     2 13660
13664 13663  O     24.798847   -3.075738   12.866376     1 13664 13665
13665 13664  H     25.329888   -3.865005   12.972601     2 13663
13666 13665  H     24.424492   -3.154654   11.988957     2 13663
13667 13666  O    -28.293991    4.396454  -21.238210     1 13667 13668
13668 13667  H    -28.365147    3.614754  -21.786036     2 13666
13669 13668  H    -27.574522    4.895681  -21.624692     2 13666
13670 13669  O      6.819365   -9.586635   20.502466     1 13670 13671
13671 13670  H      6.433785   -9.455852   21.368754     2 13669
13672 13671  H      7.667245   -9.995392   20.676389     2 13669
13673 13672  O     20.196578  -20.184459    4.006435     1 13673 13674
13674 13673  H     19.563850  -20.867890    3.785510     2 13672
13675 13674  H     19.766832  -19.671785    4.691062     2 13672
13676 13675  O      6.007436   -6.643764   11.356873     1 13676 13677
13677 13676  H      5.101656   -6.590184   11.052040     2 13675
13678 13677  H      6.200908   -5.767360   11.689612     2 13675
13679 13678  O     18.291616   -9.648930   -2.209748     1 13679 13680
13680 13679  H     17.753001   -9.857836   -1.446541     2 13678
13681 13680  H     18.962065  -10.331947   -2.224539     2 13678
13682 13681  O     12.542468  -11.844519   24.845787     1 13682 13683
13683 13682  H     12.572257  -12.442449   25.592663     2 13681
13684 13683  H     13.438685  -11.518575   24.763414     2 13681
13685 13684  O     13.330093  -31.121603    1.547792     1 13685 13686
13686 13685  H     13.368490  -30.298724    1.060320     2 13684
13687 13686  H     13.661923  -30.900716    2.418039     2 13684
13688 13687  O    -19.986279   20.163206  -12.531698     1 13688 13689
13689 13688  H    -19.672021   20.823186  -13.149679     2 13687
13690 13689  H    -19.213141   19.636318  -12.329515     2 13687
13691 13690  O      7.250515  -16.927606   17.198078     1 13691 13692
13692 13691  H      6.863183  -17.789790   17.349230     2 13690
13693 13692  H      7.733949  -17.022233   16.377366     2 13690
13694 13693  O     10.548272  -23.133922   -2.032813     1 13694 13695
13695 13694  H     10.258112  -22.382572   -1.515597     2 13693
13696 13695  H     11.387262  -22.860389   -2.403633     2 13693
13697 13696  O     14.513687  -15.919337   19.288132     1 13697 13698
13698 13697  H     14.106029  -15.632285   20.105229     2 13696
13699 13698  H     13.794667  -16.295420   18.780389     2 13696
13700 13699  O     12.392108  -12.798298   13.738404     1 13700 13701
13701 13700  H     12.769833  -13.295707   14.463758     2 13699
13702 13701  H     11.687845  -12.288091   14.138323     2 13699
13703 13702  O     -2.516586   -6.434359   26.599692     1 13703 13704
13704 13703  H     -2.369815   -7.023580   25.859753     2 13702
13705 13704  H     -1.640878   -6.258622   26.943905     2 13702
13706 13705  O     28.808534   -1.778593    6.698466     1 13706 13707
13707 13706  H     29.680296   -1.687453    6.313816     2 13705
13708 13707  H     28.247761   -1.223889    6.156184     2 13705
13709 13708  O     16.408162   -5.769385   28.732351     1 13709 13710
13710 13709  H     16.513684   -6.711142   28.597483     2 13708
13711 13710  H     17.239795   -5.391345   28.446511     2 13708
13712 13711  O     22.810673   -0.738189   -0.908881     1 13712 13713
13713 13712  H     21.943322   -0.582001   -1.282428     2 13711
13714 13713  H     22.778852   -0.323628   -0.046699     2 13711
13715 13714  O     29.967529  -20.481633    2.950772     1 13715 13716
13716 13715  H     30.444458  -20.096162    2.215800     2 13714
13717 13716  H     29.304142  -19.829077    3.175092     2 13714
13718 13717  O      8.994378  -21.426464   -4.440919     1 13718 13719
13719 13718  H      8.141690  -21.047820   -4.226948     2 13717
13720 13719  H      8.807827  -22.345883   -4.630916     2 13717
13721 13720  O     27.736106   -1.849524   15.969686     1 13721 13722
13722 13721  H     28.213001   -1.092281   15.630002     2 13720
13723 13722  H     27.316860   -1.530377   16.768816     2 13720
13724 13723  O      7.599675  -28.776883   11.917098     1 13724 13725
13725 13724  H      8.430065  -28.871604   12.383695     2 13723
13726 13725  H      7.042308  -29.467049   12.276604     2 13723
13727 13726  O     25.700445  -21.513616    1.841820     1 13727 13728
13728 13727  H     25.001729  -21.384925    1.200364     2 13726
13729 13728  H     26.331130  -22.081428    1.399036     2 13726
13730 13729  O    -34.980762   -6.777014    9.539747     1 13730 13731
13731 13730  H    -34.834672   -7.099504    8.650427     2 13729
13732 13731  H    -34.454643   -7.353772   10.093625     2 13729
13733 13732  O     -3.571811  -14.710028   15.997636     1 13733 13734
13734 13733  H     -2.787584  -14.163987   16.052954     2 13732
13735 13734  H     -4.261420  -14.111264   15.711012     2 13732
13736 13735  O     27.849912  -12.756906   12.265302     1 13736 13737
13737 13736  H     28.119369  -13.249911   13.040268     2 13735
13738 13737  H     27.532310  -13.422953   11.655597     2 13735
13739 13738  O     19.343203  -11.010289    8.242239     1 13739 13740
13740 13739  H     19.920574  -11.394342    8.902070     2 13738
13741 13740  H     19.128675  -11.737814    7.658359     2 13738
13742 13741  O     17.309068  -15.550126   19.039005     1 13742 13743
13743 13742  H     16.357625  -15.650277   19.069968     2 13741
13744 13743  H     17.455693  -14.843932   18.409702     2 13741
13745 13744  O     25.636492   -3.951312   10.206391     1 13745 13746
13746 13745  H     24.798258   -4.346928   10.445313     2 13744
13747 13746  H     26.082585   -4.625436    9.693761     2 13744
13748 13747  O     35.445348   -9.667969    2.163038     1 13748 13749
13749 13748  H     35.353898  -10.607309    2.003324     2 13747
13750 13749  H     34.887073   -9.256855    1.503079     2 13747
13751 13750  O     14.317044   -5.714309   30.878384     1 13751 13752
13752 13751  H     15.083365   -5.792860   30.310218     2 13750
13753 13752  H     14.495536   -6.310284   31.605836     2 13750
13754 13753  O     10.968839  -25.075547    7.065280     1 13754 13755
13755 13754  H     10.155220  -25.563269    7.193274     2 13753
13756 13755  H     10.770495  -24.192149    7.375925     2 13753
13757 13756  O     16.562603   -2.389774   25.075789     1 13757 13758
13758 13757  H     16.336421   -1.570229   24.635993     2 13756
13759 13758  H     15.954112   -3.033074   24.712286     2 13756
13760 13759  O     27.396754   -3.477155    7.962868     1 13760 13761
13761 13760  H     27.860084   -2.858993    7.397684     2 13759
13762 13761  H     26.569368   -3.041513    8.167511     2 13759
13763 13762  O    -18.362170   21.315048   -8.880260     1 13763 13764
13764 13763  H    -18.714351   22.204091   -8.837811     2 13762
13765 13764  H    -17.812744   21.237070   -8.100337     2 13762
13766 13765  O     -5.271798   32.984122  -11.941696     1 13766 13767
13767 13766  H     -4.552003   33.431941  -11.497190     2 13765
13768 13767  H     -4.932203   32.793170  -12.816021     2 13765
13769 13768  O      4.744241  -19.100556   24.115466     1 13769 13770
13770 13769  H      3.983575  -18.530702   24.228977     2 13768
13771 13770  H      4.804490  -19.587017   24.937633     2 13768
13772 13771  O     18.797440  -16.423158    8.047657     1 13772 13773
13773 13772  H     19.125485  -15.538174    7.888221     2 13771
13774 13773  H     19.083126  -16.628241    8.937912     2 13771
13775 13774  O     13.946914  -24.436761   14.340230     1 13775 13776
13776 13775  H     13.808926  -23.656648   13.803002     2 13774
13777 13776  H     13.105352  -24.582466   14.772404     2 13774
13778 13777  O      7.517841   -9.865754    6.772516     1 13778 13779
13779 13778  H      7.443695   -8.999882    6.371269     2 13777
13780 13779  H      6.738541   -9.942705    7.322972     2 13777
13781 13780  O      4.597542  -12.550083   -3.186383     1 13781 13782
13782 13781  H      5.438422  -12.686689   -2.749930     2 13780
13783 13782  H      3.952404  -12.582809   -2.480014     2 13780
13784 13783  O     29.797928   -0.149845    9.123483     1 13784 13785
13785 13784  H     30.680792   -0.383962    8.837175     2 13783
13786 13785  H     29.228772   -0.446527    8.413362     2 13783
13787 13786  O     28.004190  -13.932632    7.265599     1 13787 13788
13788 13787  H     27.348917  -14.528576    6.902694     2 13786
13789 13788  H     27.501464  -13.324171    7.807146     2 13786
13790 13789  O      9.964719  -11.634070   15.114061     1 13790 13791
13791 13790  H      9.704342  -11.525137   16.028703     2 13789
13792 13791  H      9.150983  -11.536216   14.619602     2 13789
13793 13792  O     13.160568  -10.148153   17.595625     1 13793 13794
13794 13793  H     12.771131   -9.275932   17.657276     2 13792
13795 13794  H     12.907802  -10.581980   18.410570     2 13792
13796 13795  O     10.215337  -12.017312   23.547740     1 13796 13797
13797 13796  H      9.954803  -12.886503   23.852471     2 13795
13798 13797  H     10.988671  -11.802033   24.069124     2 13795
13799 13798  O    -15.021942   15.926381  -17.728049     1 13799 13800
13800 13799  H    -14.194096   15.772481  -18.183262     2 13798
13801 13800  H    -15.674219   15.462139  -18.252687     2 13798
13802 13801  O     17.496590  -12.150374    4.672823     1 13802 13803
13803 13802  H     17.204752  -11.737647    5.485670     2 13801
13804 13803  H     16.850375  -12.836696    4.506689     2 13801
13805 13804  O      4.404194  -12.652210   35.043833     1 13805 13806
13806 13805  H      4.419971  -11.734717   34.771455     2 13804
13807 13806  H      4.697807  -12.637201   35.954766     2 13804
13808 13807  O     -7.500075    8.271073  -29.210916     1 13808 13809
13809 13808  H     -7.349686    7.354609  -28.979164     2 13807
13810 13809  H     -7.911695    8.235834  -30.074373     2 13807
13811 13810  O     14.937102  -11.106363   28.253127     1 13811 13812
13812 13811  H     14.537180  -10.252545   28.418321     2 13810
13813 13812  H     14.478705  -11.704340   28.843489     2 13810
13814 13813  O     20.257257   -5.904484    4.908322     1 13814 13815
13815 13814  H     20.236987   -5.459426    5.755521     2 13813
13816 13815  H     20.915463   -5.427853    4.402535     2 13813
13817 13816  O      8.762788  -21.373033    9.980680     1 13817 13818
13818 13817  H      7.859008  -21.263735    9.684932     2 13816
13819 13818  H      9.144801  -20.497949    9.913411     2 13816
13820 13819  O     13.061092  -19.106130    1.086849     1 13820 13821
13821 13820  H     13.150718  -20.048282    0.943502     2 13819
13822 13821  H     13.880142  -18.848796    1.510133     2 13819
13823 13822  O     22.166855  -16.233022    9.305596     1 13823 13824
13824 13823  H     22.015046  -15.357873    8.948806     2 13822
13825 13824  H     21.570386  -16.294806   10.051679     2 13822
13826 13825  O     29.812235   -3.766103    3.785899     1 13826 13827
13827 13826  H     29.370409   -4.318713    3.141195     2 13825
13828 13827  H     29.217013   -3.028130    3.917571     2 13825
13829 13828  O     16.116206   -9.329570   12.605484     1 13829 13830
13830 13829  H     16.902676   -9.617745   12.142180     2 13828
13831 13830  H     16.292965   -9.528330   13.524985     2 13828
13832 13831  O      5.090398  -19.886610   13.118553     1 13832 13833
13833 13832  H      5.592146  -19.119915   12.841677     2 13831
13834 13833  H      4.910490  -20.361505   12.307171     2 13831
13835 13834  O     32.441141   -3.754507   10.883964     1 13835 13836
13836 13835  H     31.874450   -3.603750   10.127416     2 13834
13837 13836  H     33.138764   -3.105249   10.794425     2 13834
13838 13837  O     -0.561108   -7.347139    7.909288     1 13838 13839
13839 13838  H     -1.399237   -7.536617    8.331034     2 13837
13840 13839  H      0.048988   -7.976164    8.294441     2 13837
13841 13840  O    -22.552276   13.450948  -17.598329     1 13841 13842
13842 13841  H    -21.783096   13.524879  -18.163242     2 13840
13843 13842  H    -22.559708   12.534612  -17.321732     2 13840
13844 13843  O     16.465417   -6.291116   15.999120     1 13844 13845
13845 13844  H     16.579565   -7.221900   15.807177     2 13843
13846 13845  H     17.179538   -6.080820   16.600816     2 13843
13847 13846  O      9.689747  -18.337338    7.703406     1 13847 13848
13848 13847  H      9.653762  -19.183742    7.257831     2 13846
13849 13848  H     10.624413  -18.167435    7.820727     2 13846
13850 13849  O     19.457468   -8.594809    4.352327     1 13850 13851
13851 13850  H     18.567459   -8.634738    4.702357     2 13849
13852 13851  H     19.823392   -7.789590    4.718324     2 13849
13853 13852  O      0.367357  -14.660277    1.946027     1 13853 13854
13854 13853  H      0.064079  -13.862865    1.511989     2 13852
13855 13854  H      0.030999  -15.372402    1.401993     2 13852
13856 13855  O      7.552443  -15.741829    3.944080     1 13856 13857
13857 13856  H      7.405707  -15.509716    4.861044     2 13855
13858 13857  H      8.248434  -16.398408    3.971138     2 13855
13859 13858  O      6.389944  -20.849473    6.475020     1 13859 13860
13860 13859  H      6.767685  -21.710147    6.656083     2 13858
13861 13860  H      6.070650  -20.912085    5.574818     2 13858
13862 13861  O     10.034650   -7.632854   25.347244     1 13862 13863
13863 13862  H      9.803274   -7.111045   24.578862     2 13861
13864 13863  H      9.193970   -7.864979   25.741714     2 13861
13865 13864  O     -2.085988  -10.874986    9.634684     1 13865 13866
13866 13865  H     -2.802001  -11.266889   10.134653     2 13864
13867 13866  H     -1.480868  -11.599084    9.474238     2 13864
13868 13867  O      6.007975  -12.834749   18.929391     1 13868 13869
13869 13868  H      5.425086  -12.594204   19.649537     2 13867
13870 13869  H      5.689081  -13.688782   18.637557     2 13867
13871 13870  O     13.523627  -15.201267    7.704918     1 13871 13872
13872 13871  H     14.260370  -15.284682    7.099540     2 13870
13873 13872  H     13.148035  -14.342907    7.509010     2 13870
13874 13873  O      5.378302  -13.452406    8.170844     1 13874 13875
13875 13874  H      5.326559  -12.880156    7.405282     2 13873
13876 13875  H      6.257831  -13.827973    8.130727     2 13873
13877 13876  O     15.570261  -12.734177   10.769648     1 13877 13878
13878 13877  H     15.756107  -12.736483   11.708630     2 13876
13879 13878  H     15.345485  -13.642334   10.567263     2 13876
13880 13879  O      2.186799  -20.473186    4.403116     1 13880 13881
13881 13880  H      2.834998  -19.768913    4.411539     2 13879
13882 13881  H      2.658684  -21.229504    4.054491     2 13879
13883 13882  O     18.934181  -17.720581   12.030094     1 13883 13884
13884 13883  H     18.631080  -18.310526   12.720258     2 13882
13885 13884  H     19.719157  -17.310138   12.392834     2 13882
13886 13885  O     16.270341  -35.623633   -0.995438     1 13886 13887
13887 13886  H     16.002288  -36.099669   -0.209455     2 13885
13888 13887  H     16.940232  -35.012403   -0.689047     2 13885
13889 13888  O     34.148750    0.965652   12.710113     1 13889 13890
13890 13889  H     34.170641    0.293665   13.391426     2 13888
13891 13890  H     33.242852    1.274798   12.706969     2 13888
13892 13891  O     14.760211  -10.732479   15.540451     1 13892 13893
13893 13892  H     14.063442  -10.657854   16.192506     2 13891
13894 13893  H     14.857383  -11.674285   15.399776     2 13891
13895 13894  O     28.071428  -14.998861   -2.808824     1 13895 13896
13896 13895  H     27.395445  -14.561973   -2.290744     2 13894
13897 13896  H     28.896721  -14.667384   -2.454922     2 13894
13898 13897  O     21.455002  -11.852115   10.318559     1 13898 13899
13899 13898  H     22.002083  -11.083558   10.480592     2 13897
13900 13899  H     21.285088  -12.213464   11.188494     2 13897
13901 13900  O     19.454614   -8.398202    7.610330     1 13901 13902
13902 13901  H     19.353348   -9.329990    7.804621     2 13900
13903 13902  H     18.648887   -8.159689    7.151914     2 13900
13904 13903  O      7.590237   -0.967012   21.691493     1 13904 13905
13905 13904  H      7.566769   -1.025639   22.646608     2 13903
13906 13905  H      8.386658   -0.471384   21.500974     2 13903
13907 13906  O     16.021202  -10.421943    9.439479     1 13907 13908
13908 13907  H     16.869009  -10.333846    9.875017     2 13906
13909 13908  H     15.559129  -11.089489    9.946532     2 13906
13910 13909  O      3.219213   -8.448944   19.972811     1 13910 13911
13911 13910  H      3.977306   -8.722536   19.456408     2 13909
13912 13911  H      3.439515   -8.694763   20.871294     2 13909
13913 13912  O     13.651443  -26.021859    3.991363     1 13913 13914
13914 13913  H     14.169856  -26.696020    3.552058     2 13912
13915 13914  H     13.935271  -26.058082    4.904796     2 13912
13916 13915  O      4.460329   -6.574142   34.927561     1 13916 13917
13917 13916  H      5.080265   -7.247033   35.208859     2 13915
13918 13917  H      3.645008   -7.050030   34.769403     2 13915
13919 13918  O      4.947653  -33.051336   13.560840     1 13919 13920
13920 13919  H      4.628059  -33.202883   14.450293     2 13918
13921 13920  H      5.900883  -33.039455   13.647107     2 13918
13922 13921  O      6.870092   -4.381399   12.630100     1 13922 13923
13923 13922  H      6.579016   -3.808766   13.339747     2 13921
13924 13923  H      7.595583   -3.908487   12.222364     2 13921
13925 13924  O     25.355147  -18.372834    2.377389     1 13925 13926
13926 13925  H     25.594890  -17.860759    1.605033     2 13924
13927 13926  H     25.289355  -19.272695    2.057778     2 13924
13928 13927  O      0.002965   33.268071  -20.721035     1 13928 13929
13929 13928  H      0.543054   33.348227  -21.507235     2 13927
13930 13929  H      0.325394   32.477694  -20.287936     2 13927
13931 13930  O      1.747420  -12.077795    9.385088     1 13931 13932
13932 13931  H      0.963478  -12.627030    9.387983     2 13930
13933 13932  H      2.409059  -12.601547    9.836918     2 13930
13934 13933  O      3.200977  -24.692846    4.373593     1 13934 13935
13935 13934  H      2.721037  -24.661794    3.545991     2 13933
13936 13935  H      2.872303  -25.477525    4.812323     2 13933
13937 13936  O     -2.234908  -21.452513    0.245666     1 13937 13938
13938 13937  H     -1.939559  -20.627607   -0.139731     2 13936
13939 13938  H     -3.172059  -21.326138    0.394023     2 13936
13940 13939  O      8.068203  -14.253511   12.804481     1 13940 13941
13941 13940  H      7.721857  -13.380106   12.987347     2 13939
13942 13941  H      8.271616  -14.616358   13.666569     2 13939
13943 13942  O     -2.256273  -13.135516   12.992719     1 13943 13944
13944 13943  H     -2.962199  -13.000620   13.624940     2 13942
13945 13944  H     -2.669657  -13.003260   12.139576     2 13942
13946 13945  O     22.654039  -12.189553   13.685236     1 13946 13947
13947 13946  H     22.381655  -12.826963   14.345348     2 13945
13948 13947  H     23.435303  -11.779130   14.055925     2 13945
13949 13948  O      4.179808  -15.970789   13.142485     1 13949 13950
13950 13949  H      4.083375  -15.222448   13.731483     2 13948
13951 13950  H      3.407665  -15.932997   12.578040     2 13948
13952 13951  O     11.396908   -1.297643   12.682036     1 13952 13953
13953 13952  H     12.201074   -1.623823   12.278112     2 13951
13954 13953  H     10.941461   -0.840643   11.974964     2 13951
13955 13954  O     10.885385   -7.720778   31.811718     1 13955 13956
13956 13955  H      9.952023   -7.928442   31.767653     2 13954
13957 13956  H     10.915980   -6.766462   31.879385     2 13954
13958 13957  O      2.012659   -8.270798   26.540782     1 13958 13959
13959 13958  H      1.352535   -8.753919   27.037833     2 13957
13960 13959  H      1.630127   -7.402482   26.414572     2 13957
13961 13960  O      8.061416   -8.535069   31.530742     1 13961 13962
13962 13961  H      8.048280   -7.832073   32.180246     2 13960
13963 13962  H      7.344161   -8.323270   30.933315     2 13960
13964 13963  O      3.454000   -3.854992   12.561573     1 13964 13965
13965 13964  H      3.455638   -4.540934   13.229191     2 13963
13966 13965  H      4.061718   -3.194629   12.894487     2 13963
13967 13966  O     10.295593  -14.868297    7.580658     1 13967 13968
13968 13967  H     10.479755  -14.207457    8.248196     2 13966
13969 13968  H     11.080618  -15.415667    7.561837     2 13966
13970 13969  O     12.734901  -18.663313   12.995258     1 13970 13971
13971 13970  H     12.223093  -17.998066   12.535117     2 13969
13972 13971  H     12.269270  -18.795683   13.821029     2 13969
13973 13972  O     21.574041  -10.160754    5.974253     1 13973 13974
13974 13973  H     20.984584  -10.148186    5.220188     2 13972
13975 13974  H     21.016851   -9.932217    6.718257     2 13972
13976 13975  O      5.421493   -6.342688   18.244836     1 13976 13977
13977 13976  H      5.063307   -5.683987   17.649818     2 13975
13978 13977  H      5.635994   -5.855931   19.040630     2 13975
13979 13978  O      7.504770  -15.217184    6.620704     1 13979 13980
13980 13979  H      7.147429  -16.103516    6.566345     2 13978
13981 13980  H      8.259177  -15.297954    7.204295     2 13978
13982 13981  O      9.030059  -11.173039   21.377107     1 13982 13983
13983 13982  H      9.401381  -11.731955   20.694492     2 13981
13984 13983  H      9.422038  -11.493663   22.189378     2 13981
13985 13984  O     17.266899  -20.348740    8.247710     1 13985 13986
13986 13985  H     17.541299  -21.212909    7.940876     2 13984
13987 13986  H     17.519869  -20.330309    9.170694     2 13984
13988 13987  O      2.131505  -34.525227    1.009759     1 13988 13989
13989 13988  H      1.247134  -34.167563    1.088464     2 13987
13990 13989  H      2.456496  -34.561869    1.909354     2 13987
13991 13990  O     18.951276  -13.836459   12.562299     1 13991 13992
13992 13991  H     18.861276  -13.336620   13.373651     2 13990
13993 13992  H     18.252862  -14.489683   12.604123     2 13990
13994 13993  O      1.077399   -9.971965   36.063310     1 13994 13995
13995 13994  H      0.971774  -10.764898   35.537636     2 13993
13996 13995  H      1.450257  -10.279634   36.889475     2 13993
13997 13996  O     28.214348   -6.647766   16.811141     1 13997 13998
13998 13997  H     28.243230   -7.277560   16.090893     2 13996
13999 13998  H     27.735461   -5.898892   16.456054     2 13996
14000 13999  O      1.073828   -5.803905    9.595018     1 14000 14001
14001 14000  H      0.306031   -6.090160    9.100267     2 13999
14002 14001  H      1.014115   -4.848579    9.599256     2 13999
14003 14002  O     16.542026  -10.326896    6.581437     1 14003 14004
14004 14003  H     16.290132  -10.440512    7.497883     2 14002
14005 14004  H     16.579744   -9.378342    6.458741     2 14002
14006 14005  O     -3.809748   -1.182238   18.931561     1 14006 14007
14007 14006  H     -3.694932   -0.390038   19.456411     2 14005
14008 14007  H     -3.744948   -1.899410   19.562194     2 14005
14009 14008  O     23.658559  -14.879224    5.520556     1 14009 14010
14010 14009  H     23.864009  -15.799786    5.357503     2 14008
14011 14010  H     23.100654  -14.624056    4.785803     2 14008
14012 14011  O      1.500670   -8.014767   11.476861     1 14012 14013
14013 14012  H      1.741695   -8.123711   12.396790     2 14011
14014 14013  H      1.687829   -7.095446   11.286986     2 14011
14015 14014  O      7.685188  -14.259180    9.852006     1 14015 14016
14016 14015  H      7.954691  -13.351543    9.992701     2 14014
14017 14016  H      7.880791  -14.698633   10.679564     2 14014
14018 14017  O     22.018438   -4.323633    3.816073     1 14018 14019
14019 14018  H     22.071304   -3.850490    2.985668     2 14017
14020 14019  H     22.754583   -3.990612    4.329316     2 14017
14021 14020  O     13.101111  -17.167043    4.368350     1 14021 14022
14022 14021  H     13.748723  -17.520133    3.758303     2 14020
14023 14022  H     12.744757  -16.398908    3.922017     2 14020
14024 14023  O     -3.478579   -9.052557   12.728693     1 14024 14025
14025 14024  H     -2.583303   -9.146034   12.403157     2 14023
14026 14025  H     -4.005525   -8.906154   11.943120     2 14023
14027 14026  O      5.480546   -9.165584   18.285587     1 14027 14028
14028 14027  H      5.567588   -8.213999   18.229543     2 14026
14029 14028  H      6.159120   -9.432537   18.905672     2 14026
14030 14029  O      2.684193  -11.251784   -6.097542     1 14030 14031
14031 14030  H      3.202868  -11.954704   -6.488836     2 14029
14032 14031  H      3.332791  -10.645993   -5.738975     2 14029
14033 14032  O     18.380310  -21.030650   10.914071     1 14033 14034
14034 14033  H     18.060043  -20.740759   11.768251     2 14032
14035 14034  H     18.320920  -21.985441   10.946908     2 14032
14036 14035  O      3.642942   -4.324501   36.003061     1 14036 14037
14037 14036  H      2.705441   -4.367343   35.814680     2 14035
14038 14037  H      3.973950   -5.192577   35.772605     2 14035
14039 14038  O     12.644882   -3.809865  -34.799667     1 14039 14040
14040 14039  H     13.571284   -3.675528  -34.999579     2 14038
14041 14040  H     12.474431   -3.234565  -34.053874     2 14038
14042 14041  O     -2.929108  -15.412426    3.871980     1 14042 14043
14043 14042  H     -2.142700  -15.431022    4.417367     2 14041
14044 14043  H     -2.803377  -16.124860    3.245194     2 14041
14045 14044  O     30.573410   -4.781443   12.572424     1 14045 14046
14046 14045  H     29.923069   -4.087264   12.465636     2 14044
14047 14046  H     31.326562   -4.485416   12.061188     2 14044
14048 14047  O     -0.535400   -9.397945   -3.760450     1 14048 14049
14049 14048  H      0.267503   -9.546216   -3.260856     2 14047
14050 14049  H     -0.422084   -9.917276   -4.556495     2 14047
14051 14050  O      4.509296  -12.863970    5.219624     1 14051 14052
14052 14051  H      4.711983  -12.113167    4.661552     2 14050
14053 14052  H      5.349108  -13.307225    5.339926     2 14050
14054 14053  O      9.651934  -14.505045   24.325887     1 14054 14055
14055 14054  H      9.036071  -14.591555   25.053528     2 14053
14056 14055  H      9.378795  -15.175165   23.699336     2 14053
14057 14056  O    -35.713968    9.764626   -1.256590     1 14057 14058
14058 14057  H    -36.071348    9.086462   -0.683349     2 14056
14059 14058  H    -36.268350   10.528834   -1.098861     2 14056
14060 14059  O      4.254271  -28.914288    2.912714     1 14060 14061
14061 14060  H      5.211438  -28.919911    2.907107     2 14059
14062 14061  H      4.007934  -29.823332    2.741868     2 14059
14063 14062  O      0.626551   22.028384  -30.750359     1 14063 14064
14064 14063  H     -0.199000   21.927340  -31.224159     2 14062
14065 14064  H      1.177648   22.547131  -31.336384     2 14062
14066 14065  O    -14.119566   33.169610    1.256841     1 14066 14067
14067 14066  H    -13.410239   33.789255    1.086175     2 14065
14068 14067  H    -13.797531   32.335872    0.914196     2 14065
14069 14068  O      4.977543  -13.425834   11.014622     1 14069 14070
14070 14069  H      5.107316  -13.336349   10.070492     2 14068
14071 14070  H      5.862884  -13.479116   11.374574     2 14068
14072 14071  O     20.984740   -4.822373   23.640856     1 14072 14073
14073 14072  H     21.487690   -5.458670   24.149184     2 14071
14074 14073  H     20.160007   -4.731902   24.118204     2 14071
14075 14074  O     15.609002  -10.417825   23.940752     1 14075 14076
14076 14075  H     15.707454   -9.936748   23.119105     2 14074
14077 14076  H     15.376838   -9.748477   24.584417     2 14074
14078 14077  O     14.701737  -18.641762    7.956126     1 14078 14079
14079 14078  H     15.569574  -19.037156    8.038312     2 14077
14080 14079  H     14.828965  -17.728290    8.212276     2 14077
14081 14080  O      7.543797  -14.918050    1.308045     1 14081 14082
14082 14081  H      7.715440  -15.790350    0.953272     2 14080
14083 14082  H      7.432418  -15.059006    2.248236     2 14080
14084 14083  O     31.717477  -13.097626    0.671508     1 14084 14085
14085 14084  H     32.049896  -12.709182   -0.137715     2 14083
14086 14085  H     30.886924  -13.501700    0.420234     2 14083
14087 14086  O     -0.154301   -4.342554    6.850062     1 14087 14088
14088 14087  H     -0.580406   -4.968720    6.264757     2 14086
14089 14088  H     -0.856457   -4.032416    7.421920     2 14086
14090 14089  O     10.861750  -18.567913   22.460117     1 14090 14091
14091 14090  H     11.684883  -18.538104   21.972475     2 14089
14092 14091  H     10.872607  -19.419283   22.897475     2 14089
14093 14092  O      2.366943  -34.565210  -15.392851     1 14093 14094
14094 14093  H      3.100429  -35.149742  -15.201666     2 14092
14095 14094  H      1.600599  -35.019220  -15.042388     2 14092
14096 14095  O     12.156208   -7.460781   16.585741     1 14096 14097
14097 14096  H     11.850842   -8.218887   16.087484     2 14095
14098 14097  H     12.551686   -6.886228   15.930213     2 14095
14099 14098  O     22.034429   -4.145491   21.134739     1 14099 14100
14100 14099  H     21.626325   -4.547921   21.901376     2 14098
14101 14100  H     22.973639   -4.182309   21.315741     2 14098
14102 14101  O     12.486505  -14.832337   11.524490     1 14102 14103
14103 14102  H     12.606708  -14.372921   12.355585     2 14101
14104 14103  H     13.182665  -15.489145   11.510475     2 14101
14105 14104  O    -23.147503   24.625885   -2.034699     1 14105 14106
14106 14105  H    -23.787309   25.275338   -1.742997     2 14104
14107 14106  H    -23.288897   24.556967   -2.978886     2 14104
14108 14107  O     10.321021   -3.836312   15.013162     1 14108 14109
14109 14108  H     10.034198   -4.515273   14.402445     2 14107
14110 14109  H     10.143527   -4.202358   15.879614     2 14107
14111 14110  O     11.079429  -22.801104    1.846315     1 14111 14112
14112 14111  H     11.136814  -23.733737    2.054002     2 14110
14113 14112  H     11.717342  -22.671837    1.144468     2 14110
14114 14113  O     21.252391  -15.626824   11.756659     1 14114 14115
14115 14114  H     20.741527  -14.858608   12.011793     2 14113
14116 14115  H     21.670123  -15.917323   12.567426     2 14113
14117 14116  O     16.569360   -9.203494    0.403442     1 14117 14118
14118 14117  H     16.024769   -9.065390    1.178412     2 14116
14119 14118  H     17.434268   -8.881548    0.657443     2 14116
14120 14119  O     -0.492522  -13.510645    9.654942     1 14120 14121
14121 14120  H     -0.779765  -13.845239    8.805372     2 14119
14122 14121  H     -0.586761  -14.254373   10.250105     2 14119
14123 14122  O     -3.237566   -6.886311   -6.216762     1 14123 14124
14124 14123  H     -2.816569   -6.844440   -5.358134     2 14122
14125 14124  H     -3.478174   -5.980330   -6.410507     2 14122
14126 14125  O      3.100478   34.402701   10.339947     1 14126 14127
14127 14126  H      3.144476   35.162047    9.758837     2 14125
14128 14127  H      3.295214   34.753855   11.208855     2 14125
14129 14128  O     11.495209   -1.633358   32.186470     1 14129 14130
14130 14129  H     10.652164   -1.636750   32.639785     2 14128
14131 14130  H     11.267758   -1.637454   31.256695     2 14128
14132 14131  O      2.149448  -16.009662   29.792316     1 14132 14133
14133 14132  H      1.447917  -16.009047   29.141098     2 14131
14134 14133  H      2.619650  -16.828963   29.637761     2 14131
14135 14134  O     29.978901   -7.275403    4.835854     1 14135 14136
14136 14135  H     29.281131   -6.963080    5.411877     2 14134
14137 14136  H     29.572868   -7.975570    4.324841     2 14134
14138 14137  O     35.238945    3.623267    4.704648     1 14138 14139
14139 14138  H     34.736609    3.974825    5.439697     2 14137
14140 14139  H     35.803152    2.956683    5.096526     2 14137
14141 14140  O     11.455396  -11.012998    8.000701     1 14141 14142
14142 14141  H     12.258531  -10.808270    8.479546     2 14140
14143 14142  H     11.103359  -11.786052    8.441937     2 14140
14144 14143  O     21.707744  -14.277613   15.336349     1 14144 14145
14145 14144  H     21.050497  -14.118879   16.013890     2 14143
14146 14145  H     21.825244  -15.227571   15.333841     2 14143
14147 14146  O      9.669807  -23.700577   18.845272     1 14147 14148
14148 14147  H     10.357007  -23.053680   19.004995     2 14146
14149 14148  H      9.167376  -23.341389   18.113987     2 14146
14150 14149  O      5.750430   -5.299076   30.766555     1 14150 14151
14151 14150  H      6.521538   -4.739548   30.674078     2 14149
14152 14151  H      5.634142   -5.393107   31.712000     2 14149
14153 14152  O     29.550800  -10.542198   -5.186050     1 14153 14154
14154 14153  H     28.941496  -10.456157   -4.452853     2 14152
14155 14154  H     29.073568  -11.058854   -5.835318     2 14152
14156 14155  O     22.857006   -3.998338   11.308327     1 14156 14157
14157 14156  H     22.470499   -4.225726   10.462669     2 14155
14158 14157  H     22.405416   -4.560758   11.937596     2 14155
14159 14158  O     26.554114   -2.664855   -3.024483     1 14159 14160
14160 14159  H     26.856577   -2.939493   -2.158849     2 14158
14161 14160  H     26.623316   -3.452528   -3.563940     2 14158
14162 14161  O      3.959009  -19.029961    9.725190     1 14162 14163
14163 14162  H      4.389183  -18.176343    9.775377     2 14161
14164 14163  H      3.203961  -18.952860   10.308448     2 14161
14165 14164  O      3.185567  -23.093013   16.351630     1 14165 14166
14166 14165  H      3.005277  -22.242940   15.950253     2 14164
14167 14166  H      2.337422  -23.385636   16.685174     2 14164
14168 14167  O      8.602007  -20.422099   15.255098     1 14168 14169
14169 14168  H      9.258883  -20.316627   15.943300     2 14167
14170 14169  H      9.100562  -20.380370   14.439050     2 14167
14171 14170  O    -20.700126   17.792734  -14.584379     1 14171 14172
14172 14171  H    -20.372725   17.193737  -13.913378     2 14170
14173 14172  H    -20.176191   18.586179  -14.474069     2 14170
14174 14173  O      2.355228   -4.597618   18.680505     1 14174 14175
14175 14174  H      1.567889   -5.141945   18.674313     2 14173
14176 14175  H      2.720719   -4.714237   19.557459     2 14173
14177 14176  O      2.725259  -12.037661   15.721786     1 14177 14178
14178 14177  H      2.013253  -12.295680   15.136375     2 14176
14179 14178  H      2.379403  -12.188766   16.601434     2 14176
14180 14179  O     11.440623   -6.768785    7.577637     1 14180 14181
14181 14180  H     10.999248   -7.598019    7.761459     2 14179
14182 14181  H     10.887093   -6.342129    6.923573     2 14179
14183 14182  O     11.943171   -6.631231    3.939509     1 14183 14184
14184 14183  H     11.931727   -6.745527    4.889791     2 14182
14185 14184  H     12.535161   -7.313508    3.622842     2 14182
14186 14185  O     32.345749   -3.385509    3.003219     1 14186 14187
14187 14186  H     31.513594   -3.733346    3.323779     2 14185
14188 14187  H     32.204480   -2.440569    2.945233     2 14185
14189 14188  O     11.946525   -5.846152   18.989814     1 14189 14190
14190 14189  H     12.158890   -6.256612   18.151568     2 14188
14191 14190  H     11.102694   -5.419449   18.841135     2 14188
14192 14191  O     24.755001  -24.492790    3.696351     1 14192 14193
14193 14192  H     24.859353  -24.424119    2.747338     2 14191
14194 14193  H     24.947543  -23.613957    4.023173     2 14191
14195 14194  O      4.859987  -20.706813   26.421812     1 14195 14196
14196 14195  H      5.741521  -20.918745   26.114868     2 14194
14197 14196  H      4.717616  -21.292292   27.165571     2 14194
14198 14197  O     12.742167   -9.344175   -2.220589     1 14198 14199
14199 14198  H     12.998652  -10.111085   -2.732737     2 14197
14200 14199  H     13.512976   -8.776848   -2.235567     2 14197
14201 14200  O      8.504073   -7.176681   18.644520     1 14201 14202
14202 14201  H      8.995887   -7.312349   19.454425     2 14200
14203 14202  H      7.611519   -6.988227   18.934458     2 14200
14204 14203  O     20.841481   -5.288073   16.262840     1 14204 14205
14205 14204  H     21.259628   -4.432144   16.356487     2 14203
14206 14205  H     21.569832   -5.907802   16.221952     2 14203
14207 14206  O      4.686276   -6.763482    5.109653     1 14207 14208
14208 14207  H      4.106717   -7.000159    4.385549     2 14206
14209 14208  H      4.317079   -7.213547    5.869500     2 14206
14210 14209  O      0.402733  -17.087371   35.754072     1 14210 14211
14211 14210  H      0.992398  -17.602383   36.304790     2 14209
14212 14211  H      0.843210  -17.044602   34.905319     2 14209
14213 14212  O     -2.150393  -36.160633  -12.629020     1 14213 14214
14214 14213  H     -2.413486  -35.303402  -12.294106     2 14212
14215 14214  H     -2.893389  -36.449666  -13.158783     2 14212
14216 14215  O     -1.923790   -4.328519   13.499187     1 14216 14217
14217 14216  H     -1.709452   -5.151535   13.938432     2 14215
14218 14217  H     -1.074790   -3.951483   13.268376     2 14215
14219 14218  O     12.125302  -14.227793   16.826215     1 14219 14220
14220 14219  H     11.468448  -14.521798   16.195077     2 14218
14221 14220  H     12.159477  -14.926154   17.479939     2 14218
14222 14221  O     23.421536  -10.139221    9.934161     1 14222 14223
14223 14222  H     23.955086  -10.050690   10.723919     2 14221
14224 14223  H     23.933519  -10.710242    9.361414     2 14221
14225 14224  O     22.508693   -3.428685    1.294882     1 14225 14226
14226 14225  H     22.687405   -2.541134    0.984161     2 14224
14227 14226  H     22.110604   -3.870025    0.544564     2 14224
14228 14227  O     10.024177   -0.134472   26.044969     1 14228 14229
14229 14228  H     10.780852    0.384364   25.772050     2 14227
14230 14229  H      9.523393    0.451600   26.612390     2 14227
14231 14230  O     10.505490   -8.826853   14.904032     1 14231 14232
14232 14231  H     10.724345   -8.458486   14.048089     2 14230
14233 14232  H     10.576900   -9.773704   14.783178     2 14230
14234 14233  O     27.310533   -6.278305    6.929930     1 14234 14235
14235 14234  H     26.552791   -6.305561    6.345708     2 14233
14236 14235  H     27.429856   -5.348821    7.125002     2 14233
14237 14236  O     18.519714   -9.093967   25.629623     1 14237 14238
14238 14237  H     18.275910  -10.013515   25.523684     2 14236
14239 14238  H     17.912929   -8.759352   26.289985     2 14236
14240 14239  O     12.292797  -17.798836    6.776166     1 14240 14241
14241 14240  H     13.092677  -18.175382    7.143093     2 14239
14242 14241  H     12.535252  -17.540141    5.887051     2 14239
14243 14242  O      4.498209   -7.125657   26.739773     1 14243 14244
14244 14243  H      4.544260   -6.824205   25.832448     2 14242
14245 14244  H      3.706117   -7.661950   26.774570     2 14242
14246 14245  O    -12.422315   15.234556  -24.920570     1 14246 14247
14247 14246  H    -12.856966   14.568007  -24.388571     2 14245
14248 14247  H    -12.502514   14.914370  -25.819058     2 14245
14249 14248  O      5.455670    1.828700   21.520851     1 14249 14250
14250 14249  H      6.139501    2.439485   21.795714     2 14248
14251 14250  H      4.670223    2.369423   21.437652     2 14248
14252 14251  O     23.684292  -13.387658    0.729176     1 14252 14253
14253 14252  H     23.767426  -12.832757    1.504680     2 14251
14254 14253  H     22.756110  -13.341981    0.499778     2 14251
14255 14254  O      6.402259  -15.060780   21.536582     1 14255 14256
14256 14255  H      6.390296  -14.119435   21.709663     2 14254
14257 14256  H      7.324460  -15.264424   21.380675     2 14254
14258 14257  O     19.730736   -8.102671    1.546558     1 14258 14259
14259 14258  H     19.449815   -7.187977    1.572052     2 14257
14260 14259  H     19.684166   -8.393497    2.457317     2 14257
14261 14260  O     17.649378   -0.985840  -33.771907     1 14261 14262
14262 14261  H     18.604898   -0.979725  -33.828258     2 14260
14263 14262  H     17.412292   -1.912162  -33.816059     2 14260
14264 14263  O     -8.318425   31.121092  -14.922215     1 14264 14265
14265 14264  H     -8.197509   32.052428  -15.107217     2 14263
14266 14265  H     -8.564426   31.090027  -13.997689     2 14263
14267 14266  O     21.187786   -9.797603   -0.470040     1 14267 14268
14268 14267  H     21.896797   -9.183640   -0.661309     2 14266
14269 14268  H     20.553891   -9.283824    0.030401     2 14266
14270 14269  O      1.205978  -20.789248    6.760920     1 14270 14271
14271 14270  H      1.736780  -20.835967    5.965748     2 14269
14272 14271  H      1.496237  -21.534146    7.287330     2 14269
14273 14272  O     26.943946   -4.412296   15.870632     1 14273 14274
14274 14273  H     26.689719   -4.670064   14.984542     2 14272
14275 14274  H     27.480458   -3.629112   15.748117     2 14272
14276 14275  O     25.890184  -13.283035    5.224999     1 14276 14277
14277 14276  H     25.835245  -12.419017    4.816726     2 14275
14278 14277  H     24.983233  -13.509066    5.431352     2 14275
14279 14278  O     25.046287  -11.363843    7.654140     1 14279 14280
14280 14279  H     24.838525  -10.657294    7.042704     2 14278
14281 14280  H     25.894276  -11.119046    8.024574     2 14278
14282 14281  O     17.084289    1.956237   28.285647     1 14282 14283
14283 14282  H     16.726060    1.556652   29.078260     2 14281
14284 14283  H     17.587179    1.255825   27.870009     2 14281
14285 14284  O      6.028512   -8.265425   29.769803     1 14285 14286
14286 14285  H      5.385590   -8.892878   29.439369     2 14284
14287 14286  H      5.588429   -7.417426   29.711021     2 14284
14288 14287  O      7.851290  -19.974895   20.952438     1 14288 14289
14289 14288  H      7.221797  -19.317638   21.249058     2 14287
14290 14289  H      7.414544  -20.413067   20.222035     2 14287
14291 14290  O      3.672269   -4.463844   21.079881     1 14291 14292
14292 14291  H      3.880040   -3.593808   21.420616     2 14290
14293 14292  H      4.507270   -4.931688   21.091141     2 14290
14294 14293  O      4.048855  -17.663502   18.194024     1 14294 14295
14295 14294  H      4.795614  -18.254596   18.289889     2 14293
14296 14295  H      3.897078  -17.619735   17.249947     2 14293
14297 14296  O      9.763435   -7.905116   21.028285     1 14297 14298
14298 14297  H      9.200549   -8.020219   21.793885     2 14296
14299 14298  H     10.652446   -8.016739   21.365078     2 14296
14300 14299  O     13.430902  -10.493909    0.528573     1 14300 14301
14301 14300  H     14.021283  -11.007167   -0.023013     2 14299
14302 14301  H     13.683273   -9.584484    0.368927     2 14299
14303 14302  O      8.584936   -8.454940   28.410405     1 14303 14304
14304 14303  H      7.819861   -8.572508   28.973495     2 14302
14305 14304  H      8.946805   -7.607952   28.670967     2 14302
14306 14305  O    -18.503686   21.456065   -4.881460     1 14306 14307
14307 14306  H    -19.094937   22.025416   -5.373896     2 14305
14308 14307  H    -17.879879   22.055131   -4.471318     2 14305
14309 14308  O      0.493150    0.341578   28.189100     1 14309 14310
14310 14309  H     -0.268411    0.878976   28.406951     2 14308
14311 14310  H      0.177532   -0.259673   27.514478     2 14308
14312 14311  O      1.088853  -19.489032   -2.317362     1 14312 14313
14313 14312  H      1.696430  -19.191794   -2.994659     2 14311
14314 14313  H      1.353032  -19.010863   -1.531362     2 14311
14315 14314  O     10.537987  -23.356447    5.016723     1 14315 14316
14316 14315  H     11.351698  -23.461609    4.523725     2 14314
14317 14316  H     10.512726  -24.113137    5.602397     2 14314
14318 14317  O     14.486815   -2.688954   30.386311     1 14318 14319
14319 14318  H     14.512765   -2.438668   31.309845     2 14317
14320 14319  H     14.585647   -3.641016   30.392816     2 14317
14321 14320  O    -31.918002   14.113417   -7.752170     1 14321 14322
14322 14321  H    -32.544267   13.605769   -7.236111     2 14320
14323 14322  H    -31.067818   13.917215   -7.358565     2 14320
14324 14323  O     30.842830   -5.426725   -0.119726     1 14324 14325
14325 14324  H     31.462775   -6.145091   -0.245620     2 14323
14326 14325  H     31.092886   -4.776169   -0.775836     2 14323
14327 14326  O     31.529182   -0.023745   20.364707     1 14327 14328
14328 14327  H     30.974139    0.020269   21.143310     2 14326
14329 14328  H     31.268328    0.733756   19.840894     2 14326
14330 14329  O      7.154008  -32.054299    8.304144     1 14330 14331
14331 14330  H      6.759198  -31.465364    8.947193     2 14329
14332 14331  H      7.877734  -31.551359    7.930642     2 14329
14333 14332  O     10.421985    1.364812   31.293188     1 14333 14334
14334 14333  H     10.661187    0.630322   30.727911     2 14332
14335 14334  H      9.493693    1.229064   31.483135     2 14332
14336 14335  O    -20.865763   20.870691   -9.760741     1 14336 14337
14337 14336  H    -19.954479   20.737695   -9.499771     2 14335
14338 14337  H    -20.855361   21.686299  -10.261647     2 14335
14339 14338  O     -1.653010   -6.169307   30.171014     1 14339 14340
14340 14339  H     -0.734954   -6.431417   30.102424     2 14338
14341 14340  H     -1.742786   -5.445212   29.551451     2 14338
14342 14341  O     28.256593   -0.342931   20.778619     1 14342 14343
14343 14342  H     28.799646   -0.093924   21.526496     2 14341
14344 14343  H     28.093202    0.479182   20.316380     2 14341
14345 14344  O    -20.423286    9.498204  -21.113550     1 14345 14346
14346 14345  H    -20.617828   10.428208  -21.229643     2 14344
14347 14346  H    -20.825035    9.271868  -20.274741     2 14344
14348 14347  O     17.205722   -7.153772   -2.073147     1 14348 14349
14349 14348  H     17.703502   -7.971327   -2.080340     2 14347
14350 14349  H     17.868447   -6.468523   -2.159524     2 14347
14351 14350  O      2.546896    1.864685    6.648623     1 14351 14352
14352 14351  H      2.796732    2.006735    7.561660     2 14350
14353 14352  H      3.356875    1.591482    6.217896     2 14350
14354 14353  O     -2.466948   -9.369087   27.040028     1 14354 14355
14355 14354  H     -2.225654   -9.220148   26.125793     2 14353
14356 14355  H     -1.633938   -9.366705   27.511537     2 14353
14357 14356  O     -2.417954  -19.580185   17.378412     1 14357 14358
14358 14357  H     -1.909345  -18.886406   17.798198     2 14356
14359 14358  H     -1.769971  -20.244667   17.144288     2 14356
14360 14359  O     11.765739   -5.390889   35.569538     1 14360 14361
14361 14360  H     12.052100   -6.254551   35.866719     2 14359
14362 14361  H     12.121796   -4.783661   36.218175     2 14359
14363 14362  O      1.840602  -19.322635   22.943186     1 14363 14364
14364 14363  H      1.417953  -18.521761   22.633024     2 14362
14365 14364  H      1.865566  -19.893652   22.175366     2 14362
14366 14365  O     19.422893   -1.875552   31.682233     1 14366 14367
14367 14366  H     19.889439   -2.164714   30.898045     2 14365
14368 14367  H     18.591707   -1.532449   31.354145     2 14365
14369 14368  O     -1.606722  -20.196378   20.295091     1 14369 14370
14370 14369  H     -1.650005  -21.013135   19.797832     2 14368
14371 14370  H     -2.462380  -20.127618   20.718593     2 14368
14372 14371  O    -25.266140   26.336839   -2.152566     1 14372 14373
14373 14372  H    -25.369946   27.001172   -2.833827     2 14371
14374 14373  H    -25.820245   25.610772   -2.438967     2 14371
14375 14374  O     35.666596   -4.015302    6.009014     1 14375 14376
14376 14375  H     36.211119   -4.743710    6.307591     2 14374
14377 14376  H     35.140233   -4.384164    5.299709     2 14374
14378 14377  O     -1.255847   -9.235341   17.200515     1 14378 14379
14379 14378  H     -1.039080   -9.341354   16.274230     2 14377
14380 14379  H     -0.421128   -9.026701   17.619972     2 14377
14381 14380  O      5.095942  -12.339881   27.544977     1 14381 14382
14382 14381  H      5.684374  -12.990892   27.927291     2 14380
14383 14382  H      4.217702  -12.677142   27.721554     2 14380
14384 14383  O     11.794950   -3.186970   29.437730     1 14384 14385
14385 14384  H     12.671601   -2.963018   29.750077     2 14383
14386 14385  H     11.914515   -3.385429   28.508994     2 14383
14387 14386  O     12.282499  -13.369612   -1.383561     1 14387 14388
14388 14387  H     11.830299  -13.292484   -2.223678     2 14386
14389 14388  H     11.586343  -13.550651   -0.752036     2 14386
14390 14389  O     16.487582  -15.422088    6.754358     1 14390 14391
14391 14390  H     17.075294  -16.046598    7.179581     2 14389
14392 14391  H     16.408400  -15.740930    5.855302     2 14389
14393 14392  O    -35.889808   -1.713046    6.177529     1 14393 14394
14394 14393  H    -36.012096   -1.321282    5.312776     2 14392
14395 14394  H    -36.478573   -2.467724    6.184536     2 14392
14396 14395  O     22.213279   -6.303212  -23.615903     1 14396 14397
14397 14396  H     21.827708   -7.167873  -23.474738     2 14395
14398 14397  H     21.462046   -5.714719  -23.690443     2 14395
14399 14398  O     13.528836    7.170156  -31.627545     1 14399 14400
14400 14399  H     13.783785    7.694000  -30.868059     2 14398
14401 14400  H     12.824281    6.607828  -31.305641     2 14398
14402 14401  O      2.597083   12.922212   -9.615306     1 14402 14403
14403 14402  H      3.228045   12.554091   -8.996755     2 14401
14404 14403  H      3.132317   13.246967  -10.339384     2 14401
14405 14404  O     17.786982   19.049728   -6.642680     1 14405 14406
14406 14405  H     17.624648   18.119877   -6.801603     2 14404
14407 14406  H     17.943332   19.108390   -5.700159     2 14404
14408 14407  O     20.493916   11.020788  -17.997641     1 14408 14409
14409 14408  H     20.808331   10.382337  -17.357521     2 14407
14410 14409  H     21.023547   11.801882  -17.837592     2 14407
14411 14410  O     29.625457    9.184281  -10.066714     1 14411 14412
14412 14411  H     29.359261    8.572112   -9.380696     2 14410
14413 14412  H     30.212316    8.676450  -10.627013     2 14410
14414 14413  O     30.302727    6.325274    3.630335     1 14414 14415
14415 14414  H     30.435526    7.264770    3.756602     2 14413
14416 14415  H     30.366945    5.953457    4.510028     2 14413
14417 14416  O     20.825791    8.479297   -9.489419     1 14417 14418
14418 14417  H     21.674481    8.129143   -9.760249     2 14416
14419 14418  H     20.788328    9.350266   -9.884694     2 14416
14420 14419  O     24.917339    6.430013  -15.149259     1 14420 14421
14421 14420  H     24.150625    6.371461  -14.579214     2 14419
14422 14421  H     25.284176    5.545896  -15.149651     2 14419
14423 14422  O     23.272726    8.511834  -12.837863     1 14423 14424
14424 14423  H     23.484387    9.415901  -13.070447     2 14422
14425 14424  H     23.433598    8.462498  -11.895569     2 14422
14426 14425  O      3.440456    5.201930  -19.736940     1 14426 14427
14427 14426  H      3.901478    5.942012  -19.342011     2 14425
14428 14427  H      2.514592    5.380288  -19.572030     2 14425
14429 14428  O      1.000530   34.762706   -3.012859     1 14429 14430
14430 14429  H      1.563091   34.936702   -2.258218     2 14428
14431 14430  H      1.017281   35.576040   -3.517279     2 14428
14432 14431  O     19.933818    9.072836  -23.206124     1 14432 14433
14433 14432  H     20.860480    8.876102  -23.068929     2 14431
14434 14433  H     19.854323   10.005525  -23.006112     2 14431
14435 14434  O      3.846817   24.978869   -7.440180     1 14435 14436
14436 14435  H      4.015218   25.251306   -6.538154     2 14434
14437 14436  H      4.353324   24.173610   -7.546197     2 14434
14438 14437  O     -1.360316    1.087301   -9.089300     1 14438 14439
14439 14438  H     -1.497773    1.393677   -8.192934     2 14437
14440 14439  H     -1.518432    0.144178   -9.047464     2 14437
14441 14440  O     15.696396   13.825405  -10.989984     1 14441 14442
14442 14441  H     14.921524   14.074609  -11.493672     2 14440
14443 14442  H     15.987416   13.004785  -11.387629     2 14440
14444 14443  O     12.474874   16.933623  -11.029235     1 14444 14445
14445 14444  H     13.341413   16.745135  -11.389533     2 14443
14446 14445  H     12.317452   16.228468  -10.401376     2 14443
14447 14446  O     12.917872   10.105048  -15.952051     1 14447 14448
14448 14447  H     11.993501    9.865356  -15.886354     2 14446
14449 14448  H     13.060947   10.710946  -15.224968     2 14446
14450 14449  O      8.809804    5.336118   -1.697227     1 14450 14451
14451 14450  H      8.065734    5.876512   -1.962868     2 14449
14452 14451  H      9.157842    5.772494   -0.919616     2 14449
14453 14452  O      8.471155   15.038093  -11.608875     1 14453 14454
14454 14453  H      8.300402   15.930768  -11.909216     2 14452
14455 14454  H      7.952119   14.485021  -12.192780     2 14452
14456 14455  O      3.884178    8.535841  -15.160181     1 14456 14457
14457 14456  H      4.459210    8.066199  -14.556024     2 14455
14458 14457  H      3.384749    9.131717  -14.601849     2 14455
14459 14458  O     10.657799    9.724198  -32.434030     1 14459 14460
14460 14459  H     11.050284    8.902942  -32.137844     2 14458
14461 14460  H      9.759123    9.490587  -32.666495     2 14458
14462 14461  O      2.874776    6.174621  -23.161787     1 14462 14463
14463 14462  H      2.307218    6.885638  -22.864189     2 14461
14464 14463  H      3.744756    6.411491  -22.840449     2 14461
14465 14464  O      3.932215   24.914844   -0.811898     1 14465 14466
14466 14465  H      4.105048   25.142090    0.101732     2 14464
14467 14466  H      3.582590   25.718369   -1.197050     2 14464
14468 14467  O      3.749656   16.176140  -23.758587     1 14468 14469
14469 14468  H      4.077158   17.068172  -23.643461     2 14467
14470 14469  H      3.074727   16.253445  -24.432921     2 14467
14471 14470  O     11.780572    5.327302  -30.770107     1 14471 14472
14472 14471  H     11.574375    4.493744  -31.193066     2 14470
14473 14472  H     12.275069    5.083522  -29.987627     2 14470
14474 14473  O    -10.074215  -26.222488   17.342612     1 14474 14475
14475 14474  H    -10.418781  -25.756534   18.104447     2 14473
14476 14475  H     -9.184489  -25.885518   17.237395     2 14473
14477 14476  O      1.903979   24.240211   -9.376399     1 14477 14478
14478 14477  H      2.571929   24.407635   -8.711535     2 14476
14479 14478  H      2.234359   24.674062  -10.163072     2 14476
14480 14479  O     10.468874   19.786090  -21.281425     1 14480 14481
14481 14480  H      9.712425   19.802263  -21.867731     2 14479
14482 14481  H     10.162679   19.313122  -20.507618     2 14479
14483 14482  O     24.118296    0.587966  -15.099416     1 14483 14484
14484 14483  H     23.643461    1.404707  -14.945470     2 14482
14485 14484  H     23.755975   -0.024590  -14.459315     2 14482
14486 14485  O     11.340582    9.987692  -28.853278     1 14486 14487
14487 14486  H     11.676978   10.324008  -29.683917     2 14485
14488 14487  H     10.741803    9.284259  -29.104033     2 14485
14489 14488  O      1.386759   16.388539   -9.276191     1 14489 14490
14490 14489  H      1.355114   16.240251  -10.221305     2 14488
14491 14490  H      1.192359   15.533442   -8.892461     2 14488
14492 14491  O      4.761939   16.493204   -5.386760     1 14492 14493
14493 14492  H      5.542785   16.218231   -4.906239     2 14491
14494 14493  H      4.715208   15.894016   -6.131758     2 14491
14495 14494  O      8.181319   19.491229  -23.030660     1 14495 14496
14496 14495  H      8.668584   19.504158  -23.854455     2 14494
14497 14496  H      8.101894   18.562409  -22.813366     2 14494
14498 14497  O     15.267705    0.744504  -17.015580     1 14498 14499
14499 14498  H     15.065822   -0.022705  -16.479984     2 14497
14500 14499  H     16.224102    0.777529  -17.036677     2 14497
14501 14500  O      8.780910   -1.550085    1.887726     1 14501 14502
14502 14501  H      9.130271   -2.376298    1.553736     2 14500
14503 14502  H      8.548331   -1.053294    1.103291     2 14500
14504 14503  O     15.541151   10.920032   -8.402010     1 14504 14505
14505 14504  H     15.935502   10.354512   -9.066017     2 14503
14506 14505  H     14.717465   10.487501   -8.176864     2 14503
14507 14506  O      2.313529   -0.182501  -29.219219     1 14507 14508
14508 14507  H      1.398591   -0.394741  -29.403809     2 14506
14509 14508  H      2.792734   -0.984380  -29.427987     2 14506
14510 14509  O      3.887364   24.275185   -3.924702     1 14510 14511
14511 14510  H      4.625749   24.817737   -4.201569     2 14509
14512 14511  H      4.257852   23.680264   -3.272752     2 14509
14513 14512  O     10.284217    3.900838  -11.511866     1 14513 14514
14514 14513  H      9.574253    4.537977  -11.590838     2 14512
14515 14514  H     11.080116    4.406934  -11.675096     2 14512
14516 14515  O      5.739494  -33.772391   -6.456538     1 14516 14517
14517 14516  H      6.025693  -33.262306   -7.214256     2 14515
14518 14517  H      4.916409  -33.363505   -6.189003     2 14515
14519 14518  O      5.060177   21.811749   -6.998414     1 14519 14520
14520 14519  H      4.901896   21.242220   -7.751286     2 14518
14521 14520  H      5.946573   21.590833   -6.712530     2 14518
14522 14521  O     -3.786297  -27.812410   15.120149     1 14522 14523
14523 14522  H     -3.208609  -28.568590   15.223588     2 14521
14524 14523  H     -3.887267  -27.715289   14.173257     2 14521
14525 14524  O      4.993583    1.269632    5.726987     1 14525 14526
14526 14525  H      5.945727    1.222204    5.640941     2 14524
14527 14526  H      4.660688    0.727268    5.011968     2 14524
14528 14527  O    -31.641437  -16.158020   -1.227726     1 14528 14529
14529 14528  H    -32.448215  -16.343417   -1.708316     2 14527
14530 14529  H    -31.440459  -15.246281   -1.438846     2 14527
14531 14530  O     -3.622667   15.983834  -12.482040     1 14531 14532
14532 14531  H     -3.709287   15.593395  -11.612392     2 14530
14533 14532  H     -4.082930   15.378782  -13.063677     2 14530
14534 14533  O     17.889288   10.951624   -5.454291     1 14534 14535
14535 14534  H     17.754010   10.602158   -6.335089     2 14533
14536 14535  H     18.745194   10.613619   -5.190835     2 14533
14537 14536  O      6.082347   23.863291   -2.237775     1 14537 14538
14538 14537  H      6.764031   24.533196   -2.185188     2 14536
14539 14538  H      5.340608   24.237866   -1.762644     2 14536
14540 14539  O     13.011402    5.098375  -28.247432     1 14540 14541
14541 14540  H     12.540363    5.842680  -27.872779     2 14539
14542 14541  H     13.934926    5.295365  -28.090808     2 14539
14543 14542  O      2.544044   -1.244297   -6.611432     1 14543 14544
14544 14543  H      2.050880   -0.901215   -7.356626     2 14542
14545 14544  H      3.461458   -1.103815   -6.845630     2 14542
14546 14545  O     18.621061   10.459864  -19.794165     1 14546 14547
14547 14546  H     19.319509   10.783240  -19.225104     2 14545
14548 14547  H     18.099402   11.235952  -19.998594     2 14545
14549 14548  O      0.575113   26.393677   -8.199002     1 14549 14550
14550 14549  H      1.010550   25.722541   -8.724551     2 14548
14551 14550  H      1.289592   26.858238   -7.763186     2 14548
14552 14551  O      6.095010    4.972795   -4.706225     1 14552 14553
14553 14552  H      5.677794    4.174271   -4.382927     2 14551
14554 14553  H      6.377152    4.753530   -5.594229     2 14551
14555 14554  O     11.621522   22.070543   -5.905454     1 14555 14556
14556 14555  H     12.319290   22.547469   -5.456127     2 14554
14557 14556  H     12.080901   21.459267   -6.481252     2 14554
14558 14557  O      1.394831   27.822762   -4.004916     1 14558 14559
14559 14558  H      0.580917   27.516780   -4.405105     2 14557
14560 14559  H      1.152954   28.635045   -3.560029     2 14557
14561 14560  O     -2.828723    3.032933  -30.763836     1 14561 14562
14562 14561  H     -1.953293    3.216773  -31.104506     2 14560
14563 14562  H     -2.673469    2.580996  -29.934450     2 14560
14564 14563  O    -16.422887  -26.601791    6.341445     1 14564 14565
14565 14564  H    -15.651608  -26.887148    5.851618     2 14563
14566 14565  H    -16.745877  -27.397032    6.765120     2 14563
14567 14566  O     15.953076    1.398926  -19.687043     1 14567 14568
14568 14567  H     15.065846    1.039973  -19.672648     2 14566
14569 14568  H     16.334704    1.129110  -18.851705     2 14566
14570 14569  O     24.683939    6.866919   -3.794470     1 14570 14571
14571 14570  H     24.821344    7.512446   -4.487757     2 14569
14572 14571  H     24.310304    6.108527   -4.243326     2 14569
14573 14572  O      1.978790    9.042092   34.401438     1 14573 14574
14574 14573  H      2.640319    9.444771   34.963987     2 14572
14575 14574  H      2.416989    8.279548   34.023629     2 14572
14576 14575  O     10.153222    3.729328   -8.632919     1 14576 14577
14577 14576  H     10.183849    4.017153   -9.545306     2 14575
14578 14577  H     10.758508    2.988801   -8.594435     2 14575
14579 14578  O     14.963190   16.534098  -11.976505     1 14579 14580
14580 14579  H     15.367572   17.021202  -11.258566     2 14578
14581 14580  H     15.697437   16.116312  -12.426581     2 14578
14582 14581  O     15.074935   22.756287   -2.212154     1 14582 14583
14583 14582  H     14.792805   21.858165   -2.038917     2 14581
14584 14583  H     14.771789   23.253786   -1.452662     2 14581
14585 14584  O     10.087084   10.130443  -12.331072     1 14585 14586
14586 14585  H      9.964869   10.934504  -11.826314     2 14584
14587 14586  H      9.230769    9.703101  -12.312771     2 14584
14588 14587  O     -2.762809  -34.817722   13.209029     1 14588 14589
14589 14588  H     -2.993580  -35.562052   13.764860     2 14587
14590 14589  H     -2.781050  -35.168401   12.318567     2 14587
14591 14590  O     16.873070    7.766419   -6.603896     1 14591 14592
14592 14591  H     17.278322    7.048670   -7.090556     2 14590
14593 14592  H     17.328496    8.550877   -6.909583     2 14590
14594 14593  O     13.562195    8.406174  -20.403282     1 14594 14595
14595 14594  H     12.768244    8.839846  -20.716016     2 14593
14596 14595  H     13.923377    9.007429  -19.751921     2 14593
14597 14596  O     19.352133   20.069353   -8.732832     1 14597 14598
14598 14597  H     18.706161   20.059722   -8.026531     2 14596
14599 14598  H     19.201212   20.899532   -9.184780     2 14596
14600 14599  O      5.021644    3.138979  -30.342122     1 14600 14601
14601 14600  H      4.836728    4.071236  -30.455852     2 14599
14602 14601  H      5.886335    3.016290  -30.733899     2 14599
14603 14602  O     -1.090734  -31.253748   -3.320844     1 14603 14604
14604 14603  H     -0.950636  -30.354844   -3.023229     2 14602
14605 14604  H     -1.726085  -31.614936   -2.702698     2 14602
14606 14605  O      8.650477   16.639154  -28.211334     1 14606 14607
14607 14606  H      8.961688   15.733985  -28.218301     2 14605
14608 14607  H      8.381079   16.793344  -27.305861     2 14605
14609 14608  O      7.803147    8.223617   -4.932673     1 14609 14610
14610 14609  H      8.605272    8.678119   -4.675274     2 14608
14611 14610  H      8.063828    7.678612   -5.675133     2 14608
14612 14611  O      2.331678   27.708189   -6.718092     1 14612 14613
14613 14612  H      3.244895   27.528368   -6.941543     2 14611
14614 14613  H      2.311081   27.692053   -5.761250     2 14611
14615 14614  O     17.552328    6.452303  -13.948823     1 14615 14616
14616 14615  H     17.341345    7.320835  -14.291417     2 14614
14617 14616  H     18.487207    6.345630  -14.124473     2 14614
14618 14617  O      4.356256    3.383361  -24.333318     1 14618 14619
14619 14618  H      4.557579    3.594848  -25.244896     2 14617
14620 14619  H      4.880679    3.999980  -23.822444     2 14617
14621 14620  O    -27.911564  -17.441165    6.309827     1 14621 14622
14622 14621  H    -27.936171  -17.026399    7.172146     2 14620
14623 14622  H    -27.838542  -18.377285    6.495781     2 14620
14624 14623  O      7.579660   15.446777   -7.128982     1 14624 14625
14625 14624  H      7.019185   14.702104   -6.910898     2 14623
14626 14625  H      7.574416   15.990006   -6.340878     2 14623
14627 14626  O      9.823885   18.836953   -2.030970     1 14627 14628
14628 14627  H     10.427107   18.999594   -2.756162     2 14626
14629 14628  H      9.399635   19.681210   -1.877756     2 14626
14630 14629  O     20.610958    5.170839  -15.079940     1 14630 14631
14631 14630  H     21.249636    5.676449  -14.577267     2 14629
14632 14631  H     20.420634    5.715943  -15.843399     2 14629
14633 14632  O     25.127604   10.691325  -16.163822     1 14633 14634
14634 14633  H     25.636922    9.884195  -16.237083     2 14632
14635 14634  H     24.803188   10.689479  -15.263276     2 14632
14636 14635  O     12.628062    9.199996  -23.900602     1 14636 14637
14637 14636  H     11.755983    8.808386  -23.852105     2 14635
14638 14637  H     12.596599    9.760660  -24.675777     2 14635
14639 14638  O      4.293085   19.253339  -26.794233     1 14639 14640
14640 14639  H      3.371043   19.187295  -27.042644     2 14638
14641 14640  H      4.607688   18.349320  -26.796877     2 14638
14642 14641  O     11.853116   22.248556   -2.535683     1 14642 14643
14643 14642  H     11.938789   22.996041   -3.127425     2 14641
14644 14643  H     11.254092   22.550454   -1.852851     2 14641
14645 14644  O      8.535611   10.778544   -8.004873     1 14645 14646
14646 14645  H      8.789113   11.410772   -7.332373     2 14644
14647 14646  H      9.310209   10.228367   -8.121215     2 14644
14648 14647  O      6.400944   14.895038  -22.713123     1 14648 14649
14649 14648  H      5.644630   15.361548  -23.068913     2 14647
14650 14649  H      6.525333   14.152999  -23.304848     2 14647
14651 14650  O     20.530303   21.665672  -11.325563     1 14651 14652
14652 14651  H     19.925774   22.279982  -10.909152     2 14650
14653 14652  H     20.008965   20.875785  -11.468799     2 14650
14654 14653  O      7.286782   13.889618  -13.830603     1 14654 14655
14655 14654  H      7.091049   14.763894  -14.167591     2 14653
14656 14655  H      7.438466   13.359294  -14.612895     2 14653
14657 14656  O     15.727713    5.724934  -28.097844     1 14657 14658
14658 14657  H     15.881653    5.931282  -29.019774     2 14656
14659 14658  H     16.545822    5.959237  -27.659629     2 14656
14660 14659  O     -8.710737  -22.169115    9.820577     1 14660 14661
14661 14660  H     -8.671224  -21.253553    9.544142     2 14659
14662 14661  H     -9.276493  -22.162487   10.592656     2 14659
14663 14662  O      8.070127    9.954669  -16.369787     1 14663 14664
14664 14663  H      8.306654   10.742673  -16.859008     2 14662
14665 14664  H      8.886074    9.676544  -15.953725     2 14662
14666 14665  O      5.018016    0.380001  -36.192847     1 14666 14667
14667 14666  H      4.149884    0.164260  -35.852207     2 14665
14668 14667  H      4.984363    1.322594  -36.355996     2 14665
14669 14668  O     16.519194    0.351145  -25.790148     1 14669 14670
14670 14669  H     16.284451    1.275255  -25.874698     2 14668
14671 14670  H     15.856539   -0.112601  -26.302065     2 14668
14672 14671  O     11.315170    2.932419  -32.140833     1 14672 14673
14673 14672  H     10.578139    2.350211  -32.325361     2 14671
14674 14673  H     11.429703    3.437189  -32.946017     2 14671
14675 14674  O     21.359760    2.925387   -8.564896     1 14675 14676
14676 14675  H     20.843408    3.669819   -8.255976     2 14674
14677 14676  H     21.466181    2.370106   -7.792517     2 14674
14678 14677  O      4.028300    5.999949  -31.190204     1 14678 14679
14679 14678  H      4.568095    6.504444  -30.581650     2 14677
14680 14679  H      3.148805    6.364031  -31.089384     2 14677
14681 14680  O     10.753754    3.608839  -28.340082     1 14681 14682
14682 14681  H     10.824220    2.924345  -27.674698     2 14680
14683 14682  H     11.533666    4.148889  -28.212354     2 14680
14684 14683  O      9.520623   -3.833404  -33.857871     1 14684 14685
14685 14684  H      9.213110   -4.485030  -34.487990     2 14683
14686 14685  H      9.990901   -3.190053  -34.388126     2 14683
14687 14686  O     10.250984    9.270606  -14.987561     1 14687 14688
14688 14687  H     10.654079    8.405735  -15.063360     2 14686
14689 14688  H     10.339146    9.496141  -14.061498     2 14686
14690 14689  O     10.639423    6.524243  -34.197099     1 14690 14691
14691 14690  H     11.182247    5.744752  -34.315286     2 14689
14692 14691  H      9.801959    6.297008  -34.601139     2 14689
14693 14692  O      7.048039   29.193100   -0.187479     1 14693 14694
14694 14693  H      6.301279   29.052797    0.394668     2 14692
14695 14694  H      7.661715   28.493484    0.036510     2 14692
14696 14695  O     11.627264   17.719804   -7.853884     1 14696 14697
14697 14696  H     10.726267   17.651941   -8.169843     2 14695
14698 14697  H     12.111806   17.075729   -8.370235     2 14695
14699 14698  O     27.808533    0.432712  -22.018008     1 14699 14700
14700 14699  H     27.974483    1.373335  -21.955401     2 14698
14701 14700  H     27.212843    0.343102  -22.761887     2 14698
14702 14701  O     14.590152   13.607896  -14.711217     1 14702 14703
14703 14702  H     13.856055   13.090921  -14.379448     2 14701
14704 14703  H     15.356172   13.049363  -14.578985     2 14701
14705 14704  O     14.247291   16.340117  -15.414425     1 14705 14706
14706 14705  H     13.451844   16.169930  -15.918935     2 14704
14707 14706  H     14.621707   15.473355  -15.257046     2 14704
14708 14707  O     36.193474    9.842270   -5.277070     1 14708 14709
14709 14708  H     36.942177    9.901832   -4.683667     2 14707
14710 14709  H     35.933725    8.921579   -5.244045     2 14707
14711 14710  O     16.796820   11.880886  -16.836872     1 14711 14712
14712 14711  H     17.750976   11.920000  -16.902353     2 14710
14713 14712  H     16.484177   12.426769  -17.558327     2 14710
14714 14713  O      6.444942   -0.970558  -22.422089     1 14714 14715
14715 14714  H      5.933435   -1.465871  -23.061822     2 14713
14716 14715  H      6.019808   -0.113687  -22.386519     2 14713
14717 14716  O     21.356039    0.579176  -19.326214     1 14717 14718
14718 14717  H     20.399923    0.550095  -19.361262     2 14716
14719 14718  H     21.637532    0.254148  -20.181404     2 14716
14720 14719  O     13.385181  -35.656073   -2.599265     1 14720 14721
14721 14720  H     13.503802  -34.706687   -2.570525     2 14719
14722 14721  H     14.274500  -36.009680   -2.581830     2 14719
14723 14722  O      6.699804   19.179302   -9.805688     1 14723 14724
14724 14723  H      6.371279   18.720301   -9.032628     2 14722
14725 14724  H      5.990667   19.773402  -10.051455     2 14722
14726 14725  O      2.682781   25.580617  -17.574131     1 14726 14727
14727 14726  H      2.298253   25.729573  -18.437950     2 14725
14728 14727  H      2.080721   26.009763  -16.966193     2 14725
14729 14728  O      4.052435   27.349392   -9.397910     1 14729 14730
14730 14729  H      4.568944   27.083958  -10.158826     2 14728
14731 14730  H      3.537664   26.573822   -9.174896     2 14728
14732 14731  O      7.261365    8.491783  -25.135592     1 14732 14733
14733 14732  H      6.505194    9.034346  -24.911845     2 14731
14734 14733  H      7.421262    8.673175  -26.061746     2 14731
14735 14734  O     21.255851    5.509196  -10.944684     1 14735 14736
14736 14735  H     21.056544    4.603940  -11.183471     2 14734
14737 14736  H     20.414063    5.961915  -10.996349     2 14734
14738 14737  O     13.605842   15.942534   -3.042550     1 14738 14739
14739 14738  H     13.246177   16.314588   -3.847813     2 14737
14740 14739  H     14.294636   15.347950   -3.339642     2 14737
14741 14740  O     -0.835049   17.239866  -13.047645     1 14741 14742
14742 14741  H     -1.667257   16.825878  -12.819005     2 14740
14743 14742  H     -1.080029   17.981914  -13.600439     2 14740
14744 14743  O     21.610868   11.024468  -11.416060     1 14744 14745
14745 14744  H     22.519271   10.756905  -11.276616     2 14743
14746 14745  H     21.658847   11.686456  -12.105771     2 14743
14747 14746  O     24.692796    0.552062   -7.217275     1 14747 14748
14748 14747  H     24.295407    1.131652   -6.567361     2 14746
14749 14748  H     24.328286   -0.311535   -7.023460     2 14746
14750 14749  O      9.796971    9.433763   -3.912732     1 14750 14751
14751 14750  H     10.491183    9.595400   -4.551618     2 14749
14752 14751  H     10.252016    9.081411   -3.147870     2 14749
14753 14752  O     -9.155111  -27.920371   14.938434     1 14753 14754
14754 14753  H    -10.071843  -28.089732   15.155575     2 14752
14755 14754  H     -9.109076  -26.972375   14.814272     2 14752
14756 14755  O     33.850691    4.883669   -7.539314     1 14756 14757
14757 14756  H     32.961377    5.033219   -7.860228     2 14755
14758 14757  H     34.379656    4.792486   -8.331851     2 14755
14759 14758  O      8.564077    4.218222  -32.713708     1 14759 14760
14760 14759  H      8.890380    3.321054  -32.783331     2 14758
14761 14760  H      8.333735    4.318816  -31.790097     2 14758
14762 14761  O     -1.261764  -27.477420   23.860142     1 14762 14763
14763 14762  H     -1.952748  -26.847978   23.653806     2 14761
14764 14763  H     -1.605733  -27.977296   24.600440     2 14761
14765 14764  O     11.110154   -0.350404   -5.645850     1 14765 14766
14766 14765  H     10.445492   -1.037243   -5.593814     2 14764
14767 14766  H     10.632796    0.459601   -5.466260     2 14764
14768 14767  O     -0.503557    9.774459  -22.011207     1 14768 14769
14769 14768  H     -0.766460   10.671231  -21.804048     2 14767
14770 14769  H     -0.553808    9.724075  -22.965758     2 14767
14771 14770  O     18.489889    3.132995  -10.030122     1 14771 14772
14772 14771  H     19.147678    2.609292   -9.572651     2 14770
14773 14772  H     18.826855    3.215588  -10.922234     2 14770
14774 14773  O     11.610399    4.442493  -17.306434     1 14774 14775
14775 14774  H     11.716399    4.440031  -18.257743     2 14773
14776 14775  H     12.388561    3.992794  -16.977090     2 14773
14777 14776  O      5.695010   14.415325  -26.905469     1 14777 14778
14778 14777  H      6.203930   14.696773  -26.145193     2 14776
14779 14778  H      6.308336   13.896776  -27.426208     2 14776
14780 14779  O     10.374081    8.361458   -8.438115     1 14780 14781
14781 14780  H     10.584207    7.939612   -7.604973     2 14779
14782 14781  H     11.162107    8.248734   -8.969659     2 14779
14783 14782  O     12.169828   10.796190  -25.910407     1 14783 14784
14784 14783  H     12.694086   11.533309  -26.223520     2 14782
14785 14784  H     11.797850   10.411902  -26.704250     2 14782
14786 14785  O     12.097051    8.912704  -10.710967     1 14786 14787
14787 14786  H     11.378348    9.321536  -11.193206     2 14785
14788 14787  H     12.459678    8.269640  -11.320231     2 14785
14789 14788  O    -20.649116   -4.126520   24.531860     1 14789 14790
14790 14789  H    -20.377507   -4.914359   25.002786     2 14788
14791 14790  H    -21.194393   -4.451246   23.815301     2 14788
14792 14791  O     33.923681    8.915548    3.661925     1 14792 14793
14793 14792  H     33.417287    8.310597    3.119864     2 14791
14794 14793  H     34.448219    9.416133    3.037020     2 14791
14795 14794  O     -1.074150   13.740947  -10.801766     1 14795 14796
14796 14795  H     -0.566127   13.488882  -10.030658     2 14794
14797 14796  H     -1.986460   13.622985  -10.537180     2 14794
14798 14797  O     12.867720   20.253063   -7.845313     1 14798 14799
14799 14798  H     13.265257   20.423136   -8.699286     2 14797
14800 14799  H     12.601043   19.334550   -7.883384     2 14797
14801 14800  O     14.193664   -1.100182  -26.662313     1 14801 14802
14802 14801  H     13.357051   -1.520052  -26.462264     2 14800
14803 14802  H     14.183207   -0.984951  -27.612494     2 14800
14804 14803  O      5.502286   21.895228    3.593201     1 14804 14805
14805 14804  H      5.195651   22.760190    3.865317     2 14803
14806 14805  H      4.964590   21.678668    2.831482     2 14803
14807 14806  O      3.379001    8.361376  -27.690866     1 14807 14808
14808 14807  H      3.835935    8.050082  -28.472236     2 14806
14809 14808  H      3.468730    7.647207  -27.059881     2 14806
14810 14809  O     19.826288    5.823593  -24.196493     1 14810 14811
14811 14810  H     18.975067    6.258297  -24.144653     2 14809
14812 14811  H     20.435319    6.517767  -24.448357     2 14809
14813 14812  O      3.980613   22.525481  -11.277458     1 14813 14814
14814 14813  H      4.435502   22.945601  -10.547522     2 14812
14815 14814  H      3.462651   23.226598  -11.672909     2 14812
14816 14815  O      5.636188    0.217147  -28.684150     1 14816 14817
14817 14816  H      6.283721   -0.485716  -28.738140     2 14815
14818 14817  H      5.128465    0.015839  -27.898069     2 14815
14819 14818  O     -0.814348   13.186196   -5.694855     1 14819 14820
14820 14819  H     -0.182373   13.776920   -5.285118     2 14818
14821 14820  H     -1.299844   13.740496   -6.305817     2 14818
14822 14821  O     13.312279    7.348315  -12.686246     1 14822 14823
14823 14822  H     13.266986    7.054433  -13.596088     2 14821
14824 14823  H     14.208729    7.667071  -12.581352     2 14821
14825 14824  O     10.724263   17.374298  -13.016770     1 14825 14826
14826 14825  H     11.257159   17.144144  -12.255663     2 14824
14827 14826  H      9.921641   17.740889  -12.645769     2 14824
14828 14827  O      4.394876   19.699730   -3.666036     1 14828 14829
14829 14828  H      3.767911   19.848206   -4.373921     2 14827
14830 14829  H      5.246488   19.669921   -4.102040     2 14827
14831 14830  O     21.007944   14.530024  -11.276569     1 14831 14832
14832 14831  H     21.359279   15.395456  -11.067229     2 14830
14833 14832  H     20.137886   14.704599  -11.635394     2 14830
14834 14833  O    -23.578363   -6.533608   23.459564     1 14834 14835
14835 14834  H    -23.656886   -6.779540   24.381292     2 14833
14836 14835  H    -24.352381   -6.912803   23.043226     2 14833
14837 14836  O     -0.189604    6.947751  -13.895211     1 14837 14838
14838 14837  H     -0.444434    7.864420  -14.000148     2 14836
14839 14838  H      0.337450    6.935130  -13.096283     2 14836
14840 14839  O      5.019492   -2.609238  -34.881627     1 14840 14841
14841 14840  H      4.348963   -2.216842  -34.322478     2 14839
14842 14841  H      4.578854   -3.347130  -35.303037     2 14839
14843 14842  O      2.502856    4.074251    2.741309     1 14843 14844
14844 14843  H      2.178814    4.124996    3.640560     2 14842
14845 14844  H      1.769158    4.373950    2.204560     2 14842
14846 14845  O      6.043377    3.046407  -33.400176     1 14846 14847
14847 14846  H      6.793784    3.508300  -33.026308     2 14845
14848 14847  H      6.241600    2.983297  -34.334497     2 14845
14849 14848  O     11.576581    7.111168  -26.617164     1 14849 14850
14850 14849  H     11.017518    6.557164  -26.072407     2 14848
14851 14850  H     11.022187    7.855743  -26.850589     2 14848
14852 14851  O      4.538424   14.986740   -7.967814     1 14852 14853
14853 14852  H      4.747709   15.084471   -8.896728     2 14851
14854 14853  H      3.584850   14.907065   -7.943743     2 14851
14855 14854  O      1.737520   35.998516  -11.512587     1 14855 14856
14856 14855  H      2.573166   35.914201  -11.053437     2 14854
14857 14856  H      1.080035   35.754696  -10.861052     2 14854
14858 14857  O     -2.483251   18.297912   -4.021191     1 14858 14859
14859 14858  H     -3.198669   17.797733   -3.628469     2 14857
14860 14859  H     -1.699977   17.777856   -3.841596     2 14857
14861 14860  O    -32.926629  -10.927285    5.632197     1 14861 14862
14862 14861  H    -32.462031  -11.124133    6.445604     2 14860
14863 14862  H    -33.038153  -11.777896    5.207632     2 14860
14864 14863  O     19.885665    8.373768  -13.733396     1 14864 14865
14865 14864  H     19.755882    8.434689  -14.679798     2 14863
14866 14865  H     20.803552    8.610956  -13.601275     2 14863
14867 14866  O     15.093654   25.465954   -5.496582     1 14867 14868
14868 14867  H     15.614198   26.043109   -6.055292     2 14866
14869 14868  H     15.726150   24.841601   -5.141103     2 14866
14870 14869  O      8.967871   14.301824  -26.295632     1 14870 14871
14871 14870  H      8.946780   13.487596  -26.798445     2 14869
14872 14871  H      9.897159   14.453604  -26.123535     2 14869
14873 14872  O      8.052664   10.523705  -21.679232     1 14873 14874
14874 14873  H      7.127531   10.597669  -21.913520     2 14872
14875 14874  H      8.402824    9.872405  -22.287038     2 14872
14876 14875  O      9.354827    4.180545  -15.248543     1 14876 14877
14877 14876  H      9.279333    3.369791  -15.751743     2 14875
14878 14877  H      9.505360    4.858634  -15.907152     2 14875
14879 14878  O      7.999792   17.841715  -12.293656     1 14879 14880
14880 14879  H      7.535674   18.336841  -11.618618     2 14878
14881 14880  H      7.576707   18.098299  -13.113044     2 14878
14882 14881  O     14.390075    8.680929   -6.241078     1 14882 14883
14883 14882  H     15.216062    8.197357   -6.252742     2 14881
14884 14883  H     14.274308    8.979982   -7.142963     2 14881
14885 14884  O     -2.856315   13.437611  -31.392724     1 14885 14886
14886 14885  H     -3.486417   14.128118  -31.598642     2 14884
14887 14886  H     -2.117958   13.897739  -30.993546     2 14884
14888 14887  O     27.233735    1.540642   -6.677062     1 14888 14889
14889 14888  H     26.933100    2.114933   -5.972760     2 14887
14890 14889  H     26.429983    1.239647   -7.100875     2 14887
14891 14890  O      4.475962    8.898069  -24.534527     1 14891 14892
14892 14891  H      3.774723    9.431201  -24.160004     2 14890
14893 14892  H      4.522382    9.171774  -25.450585     2 14890
14894 14893  O      6.464968    6.892839   -2.918250     1 14894 14895
14895 14894  H      6.247890    6.098413   -3.406097     2 14893
14896 14895  H      6.921191    7.446482   -3.551947     2 14893
14897 14896  O     -8.290825  -14.675966   24.108106     1 14897 14898
14898 14897  H     -7.631016  -15.363865   24.195741     2 14896
14899 14898  H     -8.238549  -14.408794   23.190436     2 14896
14900 14899  O     28.284422   10.117245   -4.482554     1 14900 14901
14901 14900  H     28.747595    9.918154   -3.668880     2 14899
14902 14901  H     27.636047   10.776282   -4.234541     2 14899
14903 14902  O     24.186611   -0.741071  -12.488076     1 14903 14904
14904 14903  H     24.898497   -1.305484  -12.186602     2 14902
14905 14904  H     24.191037   -0.002966  -11.878638     2 14902
14906 14905  O     10.255110   15.763629  -19.446066     1 14906 14907
14907 14906  H      9.695220   15.329243  -20.089545     2 14905
14908 14907  H     11.078679   15.916951  -19.909163     2 14905
14909 14908  O      3.889613   32.414006   -1.763112     1 14909 14910
14910 14909  H      4.835019   32.295089   -1.672023     2 14908
14911 14910  H      3.786042   32.892136   -2.585849     2 14908
14912 14911  O      4.304609   20.668629   -9.317262     1 14912 14913
14913 14912  H      3.512314   20.185647   -9.082254     2 14911
14914 14913  H      4.093998   21.082463  -10.154290     2 14911
14915 14914  O     14.386221    9.208882  -29.771771     1 14915 14916
14916 14915  H     14.372369   10.156401  -29.906852     2 14914
14917 14916  H     14.275662    9.099474  -28.827293     2 14914
14918 14917  O     21.279799   10.011976   -5.240149     1 14918 14919
14919 14918  H     21.278072   10.895876   -5.607504     2 14917
14920 14919  H     21.667909   10.114014   -4.371133     2 14917
14921 14920  O     -1.797524   11.187234   -4.135447     1 14921 14922
14922 14921  H     -1.449379   10.352312   -4.448388     2 14920
14923 14922  H     -1.538341   11.821109   -4.804222     2 14920
14924 14923  O     18.684802   13.871878   -2.321290     1 14924 14925
14925 14924  H     18.843964   14.271395   -1.466137     2 14923
14926 14925  H     19.528695   13.495519   -2.571151     2 14923
14927 14926  O      1.191040    2.872007  -33.914077     1 14927 14928
14928 14927  H      1.119891    3.820898  -34.017888     2 14926
14929 14928  H      2.132830    2.700998  -33.909844     2 14926
14930 14929  O     15.330864    9.991410    6.245274     1 14930 14931
14931 14930  H     15.807952   10.475058    6.919591     2 14929
14932 14931  H     14.692355   10.618838    5.906346     2 14929
14933 14932  O     14.191048   31.799459   -2.150972     1 14933 14934
14934 14933  H     14.363029   30.905121   -2.445614     2 14932
14935 14934  H     14.584989   31.845056   -1.279788     2 14932
14936 14935  O      3.494659  -34.192535  -12.524655     1 14936 14937
14937 14936  H      3.107531  -34.050141  -11.660891     2 14935
14938 14937  H      3.329304  -35.116462  -12.712400     2 14935
14939 14938  O      7.105208   12.744427  -24.765615     1 14939 14940
14940 14939  H      7.728270   13.417435  -25.039632     2 14938
14941 14940  H      7.643285   11.968137  -24.610437     2 14938
14942 14941  O     27.204918   -3.469349   -8.586421     1 14942 14943
14943 14942  H     26.592040   -3.119760   -9.233260     2 14941
14944 14943  H     27.367394   -4.368629   -8.871254     2 14941
14945 14944  O      7.466883    4.717757   -7.060310     1 14945 14946
14946 14945  H      8.408054    4.844227   -6.940166     2 14944
14947 14946  H      7.239843    5.288436   -7.794483     2 14944
14948 14947  O    -30.946818   -1.934521   17.073598     1 14948 14949
14949 14948  H    -31.532129   -1.728729   17.802497     2 14947
14950 14949  H    -31.147696   -1.273946   16.410635     2 14947
14951 14950  O    -23.214372  -28.236086    2.117744     1 14951 14952
14952 14951  H    -23.034094  -28.650887    2.961350     2 14950
14953 14952  H    -24.104515  -28.512438    1.899782     2 14950
14954 14953  O     12.787625   12.436213   -6.012126     1 14954 14955
14955 14954  H     12.248115   12.994514   -6.572002     2 14953
14956 14955  H     13.411114   13.036804   -5.603736     2 14953
14957 14956  O      2.748008   31.864535   -5.505820     1 14957 14958
14958 14957  H      3.304151   32.273346   -4.842637     2 14956
14959 14958  H      1.855586   32.088427   -5.241837     2 14956
14960 14959  O      7.553199    4.062187    1.943205     1 14960 14961
14961 14960  H      6.644355    4.005899    2.238274     2 14959
14962 14961  H      7.559735    4.792163    1.324073     2 14959
14963 14962  O      4.876344    4.511475   -0.160307     1 14963 14964
14964 14963  H      5.572664    5.108742   -0.433514     2 14962
14965 14964  H      4.960187    4.464759    0.792069     2 14962
14966 14965  O     33.544860   -3.295665   17.508950     1 14966 14967
14967 14966  H     34.291466   -3.683106   17.965789     2 14965
14968 14967  H     33.538575   -3.724117   16.653017     2 14965
14969 14968  O      2.501651   20.682139  -20.964761     1 14969 14970
14970 14969  H      2.834187   21.416821  -21.480411     2 14968
14971 14970  H      2.048412   20.128400  -21.600512     2 14968
14972 14971  O    -13.493722  -20.089802   13.184057     1 14972 14973
14973 14972  H    -13.245757  -19.559712   12.426595     2 14971
14974 14973  H    -13.478481  -20.990950   12.861672     2 14971
14975 14974  O      9.303441   15.258972  -16.907852     1 14975 14976
14976 14975  H      9.573542   15.659332  -17.734283     2 14974
14977 14976  H     10.051323   15.385748  -16.324044     2 14974
14978 14977  O      0.093259   30.609849   -3.055103     1 14978 14979
14979 14978  H     -0.140227   31.210167   -3.763154     2 14977
14980 14979  H      0.626377   31.136718   -2.459766     2 14977
14981 14980  O     32.281013    3.276701  -13.914664     1 14981 14982
14982 14981  H     32.367435    4.165427  -14.259526     2 14980
14983 14982  H     32.341063    2.713076  -14.685995     2 14980
14984 14983  O     26.231518   22.538771   -2.911836     1 14984 14985
14985 14984  H     25.903000   22.855244   -3.753354     2 14983
14986 14985  H     26.928533   21.924422   -3.142005     2 14983
14987 14986  O      6.407099    8.750033   -7.921559     1 14987 14988
14988 14987  H      7.025082    8.019718   -7.952691     2 14986
14989 14988  H      6.959756    9.531192   -7.897254     2 14986
14990 14989  O     12.285798   27.179954  -10.182560     1 14990 14991
14991 14990  H     11.859580   26.583028   -9.567541     2 14989
14992 14991  H     12.451975   27.972301   -9.671870     2 14989
14993 14992  O     20.367149    7.444527   -5.018771     1 14993 14994
14994 14993  H     19.606997    7.652874   -4.475640     2 14992
14995 14994  H     20.689581    8.295107   -5.316737     2 14992
14996 14995  O     22.552707   -2.874390  -18.576823     1 14996 14997
14997 14996  H     23.477654   -2.629368  -18.602707     2 14995
14998 14997  H     22.138932   -2.319812  -19.238234     2 14995
14999 14998  O     -0.115681   24.583571  -28.047077     1 14999 15000
15000 14999  H     -0.407005   23.684165  -27.897308     2 14998
15001 15000  H      0.692804   24.661445  -27.540599     2 14998
15002 15001  O     15.305593   33.906555   -3.300492     1 15002 15003
15003 15002  H     14.952255   33.179678   -2.787624     2 15001
15004 15003  H     15.345069   33.571388   -4.196225     2 15001
15005 15004  O      4.974955    3.064034  -27.004930     1 15005 15006
15006 15005  H      4.116249    2.654225  -26.900461     2 15004
15007 15006  H      5.497011    2.411633  -27.471899     2 15004
15008 15007  O      8.869398   27.190292  -15.543520     1 15008 15009
15009 15008  H      8.809431   27.907581  -16.174497     2 15007
15010 15009  H      9.760028   27.248709  -15.197692     2 15007
15011 15010  O     30.843878   13.664882   -0.180192     1 15011 15012
15012 15011  H     31.056282   14.553312   -0.466215     2 15010
15013 15012  H     31.500310   13.464150    0.486918     2 15010
15014 15013  O     14.590892   32.578127   -6.051975     1 15014 15015
15015 15014  H     14.134254   31.841065   -6.457503     2 15013
15016 15015  H     13.939073   33.278566   -6.024618     2 15013
15017 15016  O     16.990800   27.542193    0.094648     1 15017 15018
15018 15017  H     17.717231   27.514325    0.717346     2 15016
15019 15018  H     17.394691   27.359073   -0.753627     2 15016
15020 15019  O      3.564609   11.687882   -4.821884     1 15020 15021
15021 15020  H      4.297209   11.241822   -5.246808     2 15019
15022 15021  H      2.941078   10.989380   -4.623049     2 15019
15023 15022  O     -1.205211   15.778670  -25.185145     1 15023 15024
15024 15023  H     -0.326361   15.484353  -24.945911     2 15022
15025 15024  H     -1.763928   15.017153  -25.029713     2 15022
15026 15025  O      5.440980   30.292098  -11.578925     1 15026 15027
15027 15026  H      4.961211   30.402712  -12.399789     2 15025
15028 15027  H      6.202735   29.762997  -11.815598     2 15025
15029 15028  O      5.278656    7.543289  -22.418157     1 15029 15030
15030 15029  H      5.194247    8.311442  -22.983000     2 15028
15031 15030  H      5.265382    7.896802  -21.528728     2 15028
15032 15031  O     11.206691    8.241654   -1.483710     1 15032 15033
15033 15032  H     10.769657    7.450739   -1.167980     2 15031
15034 15033  H     11.788787    8.496252   -0.767766     2 15031
15035 15034  O      2.617366    8.756633   -9.992109     1 15035 15036
15036 15035  H      1.771365    9.194584   -9.898769     2 15034
15037 15036  H      2.449142    8.036729  -10.600115     2 15034
15038 15037  O     11.688990   -4.022915    3.433706     1 15038 15039
15039 15038  H     10.808401   -4.338093    3.230095     2 15037
15040 15039  H     12.155661   -4.798705    3.744512     2 15037
15041 15040  O     26.500306   11.529019  -12.402838     1 15041 15042
15042 15041  H     27.014805   11.745735  -11.625306     2 15040
15043 15042  H     27.023859   11.854011  -13.135303     2 15040
15044 15043  O     34.621812    6.149302   -5.287824     1 15044 15045
15045 15044  H     35.101674    5.516697   -4.753246     2 15043
15046 15045  H     34.408648    5.672753   -6.090129     2 15043
15047 15046  O      2.301303   31.346987  -19.931156     1 15047 15048
15048 15047  H      2.115900   31.975487  -19.233413     2 15046
15049 15048  H      3.256767   31.299360  -19.963600     2 15046
15050 15049  O     27.420422   12.453695   -2.354914     1 15050 15051
15051 15050  H     27.523081   13.273805   -2.837733     2 15049
15052 15051  H     26.644377   12.045031   -2.738292     2 15049
15053 15052  O      4.530351   11.425078   -8.235160     1 15053 15054
15054 15053  H      4.556837   10.613307   -8.741676     2 15052
15055 15054  H      5.011272   11.222982   -7.432600     2 15052
15056 15055  O      0.379147   33.291278   -5.101330     1 15056 15057
15057 15056  H      0.479116   33.769105   -4.277972     2 15055
15058 15057  H      0.352833   33.972986   -5.772756     2 15055
15059 15058  O     -1.986636   -2.117247  -16.539824     1 15059 15060
15060 15059  H     -1.452512   -2.181257  -17.331560     2 15058
15061 15060  H     -2.366404   -1.239388  -16.576853     2 15058
15062 15061  O     33.212813    7.985480   -3.337094     1 15062 15063
15063 15062  H     32.606666    7.359029   -2.941650     2 15061
15064 15063  H     33.749237    7.458996   -3.929796     2 15061
15065 15064  O    -10.099607  -12.647402   27.874858     1 15065 15066
15066 15065  H    -10.940824  -12.216708   28.026806     2 15064
15067 15066  H    -10.034911  -12.718411   26.922491     2 15064
15068 15067  O     35.115806    6.952072   -1.391289     1 15068 15069
15069 15068  H     35.831443    6.884021   -2.023320     2 15067
15070 15069  H     34.426337    7.423134   -1.859226     2 15067
15071 15070  O     10.372946   12.988450  -14.354837     1 15071 15072
15072 15071  H     10.049839   12.929147  -13.455773     2 15070
15073 15072  H      9.581834   13.008608  -14.893324     2 15070
15074 15073  O    -30.457185  -13.424300    4.979380     1 15074 15075
15075 15074  H    -30.758611  -12.574997    4.656800     2 15073
15076 15075  H    -30.132688  -13.875592    4.200105     2 15073
15077 15076  O      5.668419   15.769809  -30.609287     1 15077 15078
15078 15077  H      5.387256   16.676787  -30.488582     2 15076
15079 15078  H      6.573009   15.837617  -30.914820     2 15076
15080 15079  O     15.955270   17.610282   -8.743430     1 15080 15081
15081 15080  H     16.796358   17.416900   -9.157441     2 15079
15082 15081  H     15.765284   16.836420   -8.213076     2 15079
15083 15082  O     18.368652    9.414414   -8.003973     1 15083 15084
15084 15083  H     18.049459    9.464653   -8.904986     2 15082
15085 15084  H     19.249267    9.047338   -8.081455     2 15082
15086 15085  O      7.787889   11.654092   -3.865937     1 15086 15087
15087 15086  H      8.324805   10.868357   -3.968761     2 15085
15088 15087  H      8.258005   12.183383   -3.221675     2 15085
15089 15088  O     17.032795    9.534784  -26.602820     1 15089 15090
15090 15089  H     17.537418    8.725801  -26.518354     2 15088
15091 15090  H     16.127923    9.242783  -26.713164     2 15088
15092 15091  O     12.417983   20.155832    3.967134     1 15092 15093
15093 15092  H     11.501994   20.433356    3.953818     2 15091
15094 15093  H     12.390694   19.227009    3.737405     2 15091
15095 15094  O      9.218884    2.937493   34.674571     1 15095 15096
15096 15095  H      9.770255    3.636187   35.026775     2 15094
15097 15096  H      9.837679    2.299867   34.318541     2 15094
15098 15097  O      9.230275    5.942743  -19.894416     1 15098 15099
15099 15098  H      9.717512    5.193087  -19.552587     2 15097
15100 15099  H      9.731260    6.226028  -20.659266     2 15097
15101 15100  O      0.014349    5.097197  -30.184970     1 15101 15102
15102 15101  H      0.695604    5.126040  -29.513188     2 15100
15103 15102  H      0.127062    4.244299  -30.604603     2 15100
15104 15103  O      2.441927   15.853780   -3.773436     1 15104 15105
15105 15104  H      2.834560   15.818213   -2.901194     2 15103
15106 15105  H      3.057532   16.370990   -4.292818     2 15103
15107 15106  O    -13.642642  -17.133776   17.934779     1 15107 15108
15108 15107  H    -13.892394  -17.057272   17.013909     2 15106
15109 15108  H    -14.152102  -16.455845   18.378728     2 15106
15110 15109  O      8.899925   -2.285362  -15.845905     1 15110 15111
15111 15110  H      8.203927   -2.362102  -15.193272     2 15109
15112 15111  H      8.439054   -2.142288  -16.672561     2 15109
15113 15112  O      5.148081    3.010486   -8.631671     1 15113 15114
15114 15113  H      4.419196    3.595200   -8.424137     2 15112
15115 15114  H      5.483336    3.332521   -9.468408     2 15112
15116 15115  O     10.632562    1.758222  -26.239271     1 15116 15117
15117 15116  H     10.326296    1.344721  -25.432146     2 15115
15118 15117  H     11.169150    1.088551  -26.663352     2 15115
15119 15118  O     16.585368   12.941481   -6.849357     1 15119 15120
15120 15119  H     16.258903   12.290235   -7.470268     2 15118
15121 15120  H     16.799956   12.437954   -6.064090     2 15118
15122 15121  O      8.133706   21.187896  -18.507631     1 15122 15123
15123 15122  H      7.453010   20.956062  -19.139404     2 15121
15124 15123  H      8.651576   20.388972  -18.408826     2 15121
15125 15124  O     10.308489   29.571646   -4.734138     1 15125 15126
15126 15125  H     10.003999   30.477620   -4.681913     2 15124
15127 15126  H      9.557790   29.049479   -4.451253     2 15124
15128 15127  O     11.348638   15.502388  -14.820069     1 15128 15129
15129 15128  H     10.868144   16.018990  -14.173169     2 15127
15130 15129  H     11.196998   14.593253  -14.561787     2 15127
15131 15130  O      8.381364    0.794459  -29.550459     1 15131 15132
15132 15131  H      8.499756    1.438441  -28.852245     2 15130
15133 15132  H      7.438759    0.628748  -29.566792     2 15130
15134 15133  O     15.642644   10.830894   -0.307011     1 15134 15135
15135 15134  H     14.890448   11.422859   -0.310215     2 15133
15136 15135  H     15.775316   10.606436   -1.228015     2 15133
15137 15136  O     12.712097    5.251739  -10.974731     1 15137 15138
15138 15137  H     13.285230    6.002838  -10.821111     2 15136
15139 15138  H     13.173412    4.727842  -11.629674     2 15136
15140 15139  O     27.007419    7.264671   -1.834974     1 15140 15141
15141 15140  H     26.639951    8.129700   -1.653529     2 15139
15142 15141  H     26.894793    6.779778   -1.017401     2 15139
15143 15142  O     12.617680   13.942965  -21.730212     1 15143 15144
15144 15143  H     12.174463   13.517841  -20.996006     2 15142
15145 15144  H     13.038975   13.225841  -22.204000     2 15142
15146 15145  O      0.413036  -35.785664  -13.860351     1 15146 15147
15147 15146  H     -0.513380  -35.776693  -13.619717     2 15145
15148 15147  H      0.873161  -35.950746  -13.037391     2 15145
15149 15148  O      8.341018   25.684816  -12.530982     1 15149 15150
15150 15149  H      7.967894   25.342050  -13.343092     2 15148
15151 15150  H      9.021984   26.293296  -12.817810     2 15148
15152 15151  O     11.086206   36.208417   -1.483259     1 15152 15153
15153 15152  H     11.845215   36.526346   -1.972196     2 15151
15154 15153  H     11.290493   36.404386   -0.568877     2 15151
15155 15154  O     18.565704    8.977038   -3.265739     1 15155 15156
15156 15155  H     18.279097    9.882971   -3.150097     2 15154
15157 15156  H     18.274981    8.530024   -2.470824     2 15154
15158 15157  O      3.248979    4.835465   -7.953475     1 15158 15159
15159 15158  H      3.527269    5.750552   -7.916018     2 15157
15160 15159  H      2.543669    4.772566   -7.309414     2 15157
15161 15160  O     10.351839   23.646787   -0.448367     1 15161 15162
15162 15161  H      9.622057   23.354458   -0.994439     2 15160
15163 15162  H     10.373157   24.596654   -0.564678     2 15160
15164 15163  O     17.158882   15.767595  -13.458584     1 15164 15165
15165 15164  H     17.390108   16.013918  -14.354179     2 15163
15166 15165  H     17.390010   14.840741  -13.397336     2 15163
15167 15166  O     14.359386    8.249103  -26.895896     1 15167 15168
15168 15167  H     14.864757    7.568018  -26.452100     2 15166
15169 15168  H     13.519429    8.262109  -26.437054     2 15166
15170 15169  O     15.388244    8.052540   -3.036127     1 15170 15171
15171 15170  H     15.392982    8.879322   -3.518454     2 15169
15172 15171  H     14.662118    7.557530   -3.415519     2 15169
15173 15172  O      2.354069   10.662013  -27.009937     1 15173 15174
15174 15173  H      3.137075   11.032930  -26.603054     2 15172
15175 15174  H      2.657594    9.852383  -27.420551     2 15172
15176 15175  O      5.006647    4.897896    2.601169     1 15176 15177
15177 15176  H      4.169083    4.457638    2.745713     2 15175
15178 15177  H      5.032041    5.588731    3.263236     2 15175
15179 15178  O      4.687247   18.843587  -20.785328     1 15179 15180
15180 15179  H      3.988165   18.617193  -21.398730     2 15178
15181 15180  H      4.847748   18.036745  -20.295964     2 15178
15182 15181  O      5.425386   18.411312  -23.663469     1 15182 15183
15183 15182  H      5.116860   19.165067  -24.166356     2 15181
15184 15183  H      5.849947   18.792944  -22.895135     2 15181
15185 15184  O     19.781984    9.451945    0.260663     1 15185 15186
15186 15185  H     18.979545    9.087582   -0.112920     2 15184
15187 15186  H     19.817196    9.094960    1.148104     2 15184
15188 15187  O      0.831939   12.092122  -31.935907     1 15188 15189
15189 15188  H     -0.061271   11.883565  -31.662208     2 15187
15190 15189  H      1.189477   11.259065  -32.243176     2 15187
15191 15190  O      7.679850    1.841752   -7.875536     1 15191 15192
15192 15191  H      6.905378    2.354516   -8.106834     2 15190
15193 15192  H      8.418049    2.412684   -8.088445     2 15190
15194 15193  O      7.521664    5.770410  -25.131434     1 15194 15195
15195 15194  H      7.134037    5.342090  -24.368205     2 15193
15196 15195  H      7.327053    6.699684  -25.009748     2 15193
15197 15196  O      4.017085    5.330583   35.910569     1 15197 15198
15198 15197  H      3.170844    5.137097   35.507246     2 15196
15199 15198  H      3.938216    4.998586   36.804878     2 15196
15200 15199  O     13.627359   12.025064  -23.251245     1 15200 15201
15201 15200  H     13.521949   12.579534  -24.024344     2 15199
15202 15201  H     13.065770   11.268539  -23.420120     2 15199
15203 15202  O     15.725720   14.244751   -3.367746     1 15203 15204
15204 15203  H     15.281194   13.448323   -3.077346     2 15202
15205 15204  H     16.653391   14.009407   -3.384196     2 15202
15206 15205  O     23.390326    6.669899   -9.674677     1 15206 15207
15207 15206  H     22.660929    6.218268  -10.099224     2 15205
15208 15207  H     24.153236    6.448361  -10.208645     2 15205
15209 15208  O      7.766900   17.336749  -25.859122     1 15209 15210
15210 15209  H      8.340013   17.050912  -25.147736     2 15208
15211 15210  H      6.888224   17.322962  -25.479688     2 15208
15212 15211  O     31.814117   14.092783   -5.039273     1 15212 15213
15213 15212  H     31.258765   13.618353   -4.420620     2 15211
15214 15213  H     32.708074   13.887016   -4.765900     2 15211
15215 15214  O     32.945771    5.826904  -14.857897     1 15215 15216
15216 15215  H     32.202066    6.393704  -14.653270     2 15214
15217 15216  H     33.403977    6.278674  -15.566545     2 15214
15218 15217  O     19.507831   11.871107  -22.289429     1 15218 15219
15219 15218  H     19.402751   11.839022  -21.338556     2 15217
15220 15219  H     20.360961   12.284161  -22.422797     2 15217
15221 15220  O      1.898908   17.343696  -25.463357     1 15221 15222
15222 15221  H      1.136683   17.812936  -25.802560     2 15220
15223 15222  H      2.443012   17.180986  -26.233881     2 15220
15224 15223  O      0.524672    3.379658   -4.328141     1 15224 15225
15225 15224  H      1.056199    4.133751   -4.073084     2 15223
15226 15225  H      1.012664    2.621981   -4.005618     2 15223
15227 15226  O     11.311042   13.031020    4.169606     1 15227 15228
15228 15227  H     11.527295   13.593299    4.913453     2 15226
15229 15228  H     11.195708   13.636097    3.436932     2 15226
15230 15229  O     17.877726    8.516076  -21.599464     1 15230 15231
15231 15230  H     18.597014    8.579494  -22.227822     2 15229
15232 15231  H     18.086584    9.166671  -20.929139     2 15229
15233 15232  O      4.192251   16.519835  -27.561319     1 15233 15234
15234 15233  H      3.803140   16.029321  -28.285350     2 15232
15235 15234  H      4.880993   15.946151  -27.225534     2 15232
15236 15235  O     22.485877    7.041831  -20.464437     1 15236 15237
15237 15236  H     22.898402    6.314928  -19.997891     2 15235
15238 15237  H     21.621220    6.711027  -20.707684     2 15235
15239 15238  O     -0.572092   22.533874   -3.712783     1 15239 15240
15240 15239  H     -0.130401   23.380610   -3.777419     2 15238
15241 15240  H     -0.763004   22.292967   -4.619286     2 15238
15242 15241  O      4.054607   18.115854  -30.835010     1 15242 15243
15243 15242  H      4.206162   19.059609  -30.784129     2 15241
15244 15243  H      3.116188   18.014563  -30.675820     2 15241
15245 15244  O      5.822040   24.041207   -9.883705     1 15245 15246
15246 15245  H      6.287172   23.389308  -10.408026     2 15244
15247 15246  H      5.895602   24.851553  -10.387847     2 15244
15248 15247  O     16.114434    9.071320  -10.177180     1 15248 15249
15249 15248  H     15.689597    8.213717  -10.161004     2 15247
15250 15249  H     16.950674    8.916638  -10.616507     2 15247
15251 15250  O      9.313087   16.450630  -23.638759     1 15251 15252
15252 15251  H      9.352715   15.760462  -22.976695     2 15250
15253 15252  H     10.003119   16.224743  -24.262507     2 15250
15254 15253  O      2.127879    4.539161   -0.912743     1 15254 15255
15255 15254  H      2.117683    4.832553   -1.823813     2 15253
15256 15255  H      3.040396    4.302293   -0.747096     2 15253
15257 15256  O      9.308519    1.908879   -5.189001     1 15257 15258
15258 15257  H      8.643644    2.091365   -5.852983     2 15256
15259 15258  H      8.830570    1.925643   -4.359835     2 15256
15260 15259  O      3.365872   13.610827  -22.794322     1 15260 15261
15261 15260  H      3.439648   13.877234  -21.877907     2 15259
15262 15261  H      3.695684   14.360651  -23.289519     2 15259
15263 15262  O      3.503388   11.970918  -17.503543     1 15263 15264
15264 15263  H      2.831043   12.085501  -18.175149     2 15262
15265 15264  H      3.601221   11.022289  -17.421291     2 15262
15266 15265  O    -29.409068  -17.290703    3.983417     1 15266 15267
15267 15266  H    -29.020163  -17.256264    4.857373     2 15265
15268 15267  H    -29.890729  -18.117734    3.967498     2 15265
15269 15268  O      7.921526   12.897818  -16.149260     1 15269 15270
15270 15269  H      7.678552   12.449264  -16.959194     2 15268
15271 15270  H      8.320491   13.718046  -16.439579     2 15268
15272 15271  O      5.494382   16.088748  -14.734655     1 15272 15273
15273 15272  H      4.798413   15.918183  -14.100017     2 15271
15274 15273  H      5.270901   15.542760  -15.488436     2 15271
15275 15274  O     29.590542   16.461204   -5.600668     1 15275 15276
15276 15275  H     29.890220   15.758016   -6.176820     2 15274
15277 15276  H     28.929722   16.926492   -6.113558     2 15274
15278 15277  O     -4.559845  -30.865558   10.139787     1 15278 15279
15279 15278  H     -4.758303  -31.175697   11.023337     2 15277
15280 15279  H     -3.936477  -31.505084    9.795329     2 15277
15281 15280  O    -20.082892  -11.149216   22.027954     1 15281 15282
15282 15281  H    -20.655240  -11.172585   21.261075     2 15280
15283 15282  H    -19.338450  -11.701309   21.788721     2 15280
15284 15283  O     18.899034    2.620070   -4.324015     1 15284 15285
15285 15284  H     18.923057    3.245643   -3.599919     2 15283
15286 15285  H     18.024953    2.232697   -4.277596     2 15283
15287 15286  O     -3.875395   10.473918  -27.244320     1 15287 15288
15288 15287  H     -4.159287   10.164931  -26.383993     2 15286
15289 15288  H     -4.078630    9.751093  -27.837997     2 15286
15290 15289  O     17.894752   12.644918  -12.751486     1 15290 15291
15291 15290  H     18.430197   12.079203  -13.307810     2 15289
15292 15291  H     18.137022   12.401618  -11.857986     2 15289
15293 15292  O     13.871176   12.180907   -2.999329     1 15293 15294
15294 15293  H     13.280996   12.403505   -2.279350     2 15292
15295 15294  H     13.306578   11.770449   -3.654298     2 15292
15296 15295  O      3.758163   13.343314   -2.568532     1 15296 15297
15297 15296  H      2.817854   13.394666   -2.397025     2 15295
15298 15297  H      3.822561   12.939261   -3.433879     2 15295
15299 15298  O     -3.188993  -25.404661   24.145714     1 15299 15300
15300 15299  H     -3.898174  -25.889472   24.567913     2 15298
15301 15300  H     -3.588102  -24.574933   23.884000     2 15298
15302 15301  O     16.632621   28.520667   -6.583714     1 15302 15303
15303 15302  H     17.035949   27.775814   -7.029531     2 15301
15304 15303  H     17.115403   28.597956   -5.760805     2 15301
15305 15304  O      9.867482    4.921951  -25.890675     1 15305 15306
15306 15305  H      8.942559    5.097412  -25.717574     2 15304
15307 15306  H      9.878028    4.529638  -26.763722     2 15304
15308 15307  O      5.319187   26.363971  -11.725211     1 15308 15309
15309 15308  H      5.865691   27.040617  -12.124856     2 15307
15310 15309  H      5.410730   25.608000  -12.305176     2 15307
15311 15310  O     -8.755677   26.562521   12.497563     1 15311 15312
15312 15311  H     -9.372824   26.418219   11.780250     2 15310
15313 15312  H     -8.006112   26.006554   12.284757     2 15310
15314 15313  O     31.384169    7.678185  -11.467234     1 15314 15315
15315 15314  H     31.112285    6.762310  -11.408217     2 15313
15316 15315  H     32.185975    7.724535  -10.946473     2 15313
15317 15316  O      8.924849    7.150073  -32.134347     1 15317 15318
15318 15317  H      9.584333    6.559422  -32.498273     2 15316
15319 15318  H      8.239325    7.184641  -32.801501     2 15316
15320 15319  O     22.853639   10.048157   -8.173564     1 15320 15321
15321 15320  H     22.244100    9.321733   -8.043170     2 15319
15322 15321  H     23.346765    9.809700   -8.958547     2 15319
15323 15322  O    -33.089406   -1.095099   18.701347     1 15323 15324
15324 15323  H    -33.601300   -1.855347   18.977426     2 15322
15325 15324  H    -33.690918   -0.584850   18.159073     2 15322
15326 15325  O     27.414734   16.626395   -0.246170     1 15326 15327
15327 15326  H     27.733400   17.528317   -0.211234     2 15325
15328 15327  H     26.868468   16.595127   -1.031566     2 15325
15329 15328  O     -1.211774  -27.554908  -20.671308     1 15329 15330
15330 15329  H     -0.847015  -27.892896  -19.853416     2 15328
15331 15330  H     -1.820458  -26.868895  -20.397225     2 15328
15332 15331  O     21.019893   13.273229   -4.211411     1 15332 15333
15333 15332  H     21.723828   12.700596   -3.906782     2 15331
15334 15333  H     20.869035   13.006522   -5.118241     2 15331
15335 15334  O      8.987377    1.520898  -33.150571     1 15335 15336
15336 15335  H      9.531257    0.770026  -32.912627     2 15334
15337 15336  H      8.116016    1.150840  -33.292058     2 15334
15338 15337  O      5.127385   10.289151  -31.703574     1 15338 15339
15339 15338  H      5.019376   11.210282  -31.466756     2 15337
15340 15339  H      5.920814   10.270377  -32.238689     2 15337
15341 15340  O     23.767420   16.742587  -12.699011     1 15341 15342
15342 15341  H     24.171288   16.622512  -11.839532     2 15340
15343 15342  H     24.256704   16.157989  -13.277870     2 15340
15344 15343  O      8.117766    5.923234  -35.762510     1 15344 15345
15345 15344  H      7.674737    6.482653  -35.124539     2 15343
15346 15345  H      7.605743    5.114518  -35.769009     2 15343
15347 15346  O     22.187962    2.430082  -14.649414     1 15347 15348
15348 15347  H     22.035584    2.765818  -13.766072     2 15346
15349 15348  H     21.676678    3.006940  -15.216913     2 15346
15350 15349  O     29.522161    4.541036  -14.623311     1 15350 15351
15351 15350  H     30.258625    3.940020  -14.510919     2 15349
15352 15351  H     28.869161    4.241359  -13.990843     2 15349
15353 15352  O      7.516101   25.076087  -14.833113     1 15353 15354
15354 15353  H      7.008122   24.941581  -15.633173     2 15352
15355 15354  H      7.961163   25.912528  -14.969192     2 15352
15356 15355  O     25.708989   -0.253034  -24.046388     1 15356 15357
15357 15356  H     25.165434    0.531600  -24.118013     2 15355
15358 15357  H     25.784915   -0.575193  -24.944541     2 15355
15359 15358  O     -3.031355   -3.438526  -29.992127     1 15359 15360
15360 15359  H     -3.136906   -4.174964  -30.594413     2 15358
15361 15360  H     -3.442933   -2.700242  -30.441318     2 15358
15362 15361  O     16.543009    3.181379  -26.527471     1 15362 15363
15363 15362  H     16.060986    3.924404  -26.890513     2 15361
15364 15363  H     17.446740    3.320067  -26.810785     2 15361
15365 15364  O     -2.029743   18.646503    1.001718     1 15365 15366
15366 15365  H     -2.841398   18.459497    0.530044     2 15364
15367 15366  H     -1.847466   17.845310    1.492732     2 15364
15368 15367  O     26.341002    5.479584  -20.992993     1 15368 15369
15369 15368  H     27.211364    5.124893  -20.811622     2 15367
15370 15369  H     26.286715    6.269253  -20.454748     2 15367
15371 15370  O     10.903235    7.031499  -21.851664     1 15371 15372
15372 15371  H     11.212419    6.679507  -22.686373     2 15370
15373 15372  H     11.695468    7.125873  -21.322805     2 15370
15374 15373  O     25.788141    7.355417  -18.861139     1 15374 15375
15375 15374  H     24.994293    6.864153  -18.649719     2 15373
15376 15375  H     25.809968    8.064366  -18.218375     2 15373
15377 15376  O     -3.788416  -32.067570   16.758224     1 15377 15378
15378 15377  H     -4.444961  -32.328419   17.404087     2 15376
15379 15378  H     -3.015097  -32.586670   16.979008     2 15376
15380 15379  O     31.882890   16.472025   -0.842358     1 15380 15381
15381 15380  H     32.644928   16.077112   -1.266119     2 15379
15382 15381  H     31.372381   16.841651   -1.562767     2 15379
15383 15382  O     18.429005    9.136871  -11.655885     1 15383 15384
15384 15383  H     18.499442    9.008391  -12.601804     2 15382
15385 15384  H     18.909152    9.947614  -11.487402     2 15382
15386 15385  O     21.842899   19.073652   -8.095935     1 15386 15387
15387 15386  H     21.749441   19.149232   -7.146311     2 15385
15388 15387  H     21.047002   19.472281   -8.447892     2 15385
15389 15388  O     22.304706    0.913043  -22.226552     1 15389 15390
15390 15389  H     22.977388    1.570454  -22.048956     2 15388
15391 15390  H     22.795097    0.114040  -22.419796     2 15388
15392 15391  O    -13.653873  -22.623299   12.030829     1 15392 15393
15393 15392  H    -14.401818  -22.706977   11.439384     2 15391
15394 15393  H    -13.655775  -23.435958   12.536610     2 15391
15395 15394  O    -12.800854  -14.612706   24.391888     1 15395 15396
15396 15395  H    -13.682605  -14.806250   24.710143     2 15394
15397 15396  H    -12.890774  -14.582377   23.439403     2 15394
15398 15397  O      9.051027   14.692813  -21.625566     1 15398 15399
15399 15398  H      8.151421   14.654668  -21.950353     2 15397
15400 15399  H      9.308324   13.776527  -21.523342     2 15397
15401 15400  O     31.707104   10.814963   -9.560955     1 15401 15402
15402 15401  H     31.801374   10.804704   -8.608464     2 15400
15403 15402  H     30.937649   10.271848   -9.731825     2 15400
15404 15403  O     24.950428    3.565501  -11.660200     1 15404 15405
15405 15404  H     24.800467    4.481544  -11.893887     2 15403
15406 15405  H     24.082385    3.229625  -11.436775     2 15403
15407 15406  O      7.080120   11.655117  -10.299557     1 15407 15408
15408 15407  H      7.513530   11.687653   -9.446722     2 15406
15409 15408  H      6.152515   11.540366  -10.093127     2 15406
15410 15409  O     18.465042    3.535987  -16.960857     1 15410 15411
15411 15410  H     19.012349    4.233272  -17.322080     2 15409
15412 15411  H     18.009077    3.945375  -16.225515     2 15409
15413 15412  O     13.238751   18.373352   -1.579191     1 15413 15414
15414 15413  H     13.153426   17.475823   -1.900739     2 15412
15415 15414  H     13.868052   18.782313   -2.173298     2 15412
15416 15415  O      9.142335   13.294378   -7.053861     1 15416 15417
15417 15416  H      8.781218   14.148564   -7.290907     2 15415
15418 15417  H      9.360062   13.375191   -6.125262     2 15415
15419 15418  O     11.513435   20.658310  -15.150906     1 15419 15420
15420 15419  H     12.189053   20.320524  -14.562968     2 15418
15421 15420  H     11.072125   19.876747  -15.483528     2 15418
15422 15421  O     24.986422    8.850437   -5.479765     1 15422 15423
15423 15422  H     24.633965    8.188316   -6.074410     2 15421
15424 15423  H     25.180429    9.599796   -6.042840     2 15421
15425 15424  O      2.525974   10.747042  -23.304415     1 15425 15426
15426 15425  H      2.614587   11.688769  -23.451151     2 15424
15427 15426  H      1.652136   10.534279  -23.632089     2 15424
15428 15427  O      2.344457    7.668089    3.236584     1 15428 15429
15429 15428  H      2.372606    6.893418    3.798121     2 15427
15430 15429  H      2.318444    7.318139    2.346028     2 15427
15431 15430  O    -35.368949    2.558373  -11.962744     1 15431 15432
15432 15431  H    -35.779158    3.421709  -12.013843     2 15430
15433 15432  H    -34.502256    2.681175  -12.350037     2 15430
15434 15433  O     12.760226   11.700510  -19.646761     1 15434 15435
15435 15434  H     12.516584   12.475714  -19.140867     2 15433
15436 15435  H     13.508989   11.333036  -19.177135     2 15433
15437 15436  O     -3.824367  -27.324940   18.805553     1 15437 15438
15438 15437  H     -3.139317  -27.816093   19.259101     2 15436
15439 15438  H     -3.653061  -27.476592   17.876097     2 15436
15440 15439  O      3.743633   11.015449   -1.152476     1 15440 15441
15441 15440  H      4.030430   10.193266   -1.549964     2 15439
15442 15441  H      4.124988   11.696016   -1.707119     2 15439
15443 15442  O     -7.268877  -32.866051   11.935699     1 15443 15444
15444 15443  H     -7.237853  -31.909495   11.919320     2 15442
15445 15444  H     -8.040740  -33.072138   12.462943     2 15442
15446 15445  O     -1.481276   11.127934   -7.551067     1 15446 15447
15447 15446  H     -2.393739   11.217817   -7.825956     2 15445
15448 15447  H     -1.233784   12.002525   -7.250949     2 15445
15449 15448  O      5.354881   -2.584812  -24.127273     1 15449 15450
15450 15449  H      6.214398   -3.005453  -24.104411     2 15448
15451 15450  H      5.285294   -2.229046  -25.013174     2 15448
15452 15451  O     16.970270    0.073813   -6.337697     1 15452 15453
15453 15452  H     16.190693    0.535781   -6.646042     2 15451
15454 15453  H     17.696999    0.499052   -6.792964     2 15451
15455 15454  O     19.213813    0.141940   -8.047020     1 15455 15456
15456 15455  H     19.739439    0.905543   -7.808570     2 15454
15457 15456  H     19.846377   -0.484504   -8.398676     2 15454
15458 15457  O     -9.301026    8.476129    5.994461     1 15458 15459
15459 15458  H     -8.982578    9.084586    5.327676     2 15457
15460 15459  H     -9.069528    7.609982    5.659156     2 15457
15461 15460  O      8.124209   21.087692    1.403598     1 15461 15462
15462 15461  H      8.222631   21.826158    2.004608     2 15460
15463 15462  H      7.213469   20.812481    1.508680     2 15460
15464 15463  O     18.009082    2.718835   -0.381973     1 15464 15465
15465 15464  H     17.769951    2.134572    0.337530     2 15463
15466 15465  H     17.378644    2.518170   -1.073720     2 15463
15467 15466  O     10.190835   -3.025345   -5.456061     1 15467 15468
15468 15467  H     10.037539   -3.416796   -4.596120     2 15466
15469 15468  H     11.075925   -3.303237   -5.691910     2 15466
15470 15469  O      0.181000   17.415455  -15.633752     1 15470 15471
15471 15470  H     -0.493414   16.741037  -15.552768     2 15469
15472 15471  H     -0.138790   17.992585  -16.327213     2 15469
15473 15472  O      2.263737   10.745392  -13.865799     1 15473 15474
15474 15473  H      2.310709   11.512012  -13.294555     2 15472
15475 15474  H      1.445435   10.313386  -13.620884     2 15472
15476 15475  O      4.988922   10.586836  -21.795644     1 15476 15477
15477 15476  H      4.340314   10.664391  -21.095983     2 15475
15478 15477  H      4.562984   10.971883  -22.561507     2 15475
15479 15478  O     14.640738   18.835524  -14.310270     1 15479 15480
15480 15479  H     14.480292   17.902904  -14.454175     2 15478
15481 15480  H     14.777321   18.912637  -13.366008     2 15478
15482 15481  O     23.405807   10.518987    0.681414     1 15482 15483
15483 15482  H     22.695540   10.979105    0.234150     2 15481
15484 15483  H     23.052466   10.316292    1.547611     2 15481
15485 15484  O     12.108701   17.433999  -18.403129     1 15485 15486
15486 15485  H     12.574127   18.254865  -18.563718     2 15484
15487 15486  H     11.200288   17.697839  -18.256825     2 15484
15488 15487  O     26.957685   17.943402   -3.515802     1 15488 15489
15489 15488  H     27.802647   17.527926   -3.687995     2 15487
15490 15489  H     26.456175   17.279966   -3.041910     2 15487
15491 15490  O     28.635531    4.298065  -20.913921     1 15491 15492
15492 15491  H     28.892170    5.156710  -20.577622     2 15490
15493 15492  H     29.438262    3.777709  -20.880996     2 15490
15494 15493  O      0.663455    6.944227  -11.377902     1 15494 15495
15495 15494  H      0.987240    6.145005  -10.962404     2 15493
15496 15495  H     -0.114416    7.179461  -10.872121     2 15493
15497 15496  O      1.902814   32.847578   -9.823212     1 15497 15498
15498 15497  H      2.730628   32.601122  -10.235781     2 15496
15499 15498  H      1.421281   33.310249  -10.508992     2 15496
15500 15499  O    -31.580286  -10.891541    8.176388     1 15500 15501
15501 15500  H    -30.674248  -10.983606    7.881684     2 15499
15502 15501  H    -31.649569  -11.481326    8.927112     2 15499
15503 15502  O     -1.724330  -18.555075   32.534354     1 15503 15504
15504 15503  H     -0.897348  -18.997633   32.343373     2 15502
15505 15504  H     -2.368961  -19.004881   31.988134     2 15502
15506 15505  O     -0.162325   21.211291  -28.267026     1 15506 15507
15507 15506  H     -1.030507   20.858114  -28.461338     2 15505
15508 15507  H      0.130552   21.596218  -29.093032     2 15505
15509 15508  O     15.026261   19.961427   -3.455492     1 15509 15510
15510 15509  H     15.910382   20.174655   -3.157004     2 15508
15511 15510  H     15.129110   19.759500   -4.385481     2 15508
15512 15511  O      1.551444   17.470693  -30.241594     1 15512 15513
15513 15512  H      1.645191   16.528603  -30.100487     2 15511
15514 15513  H      0.628450   17.589092  -30.465858     2 15511
15515 15514  O    -13.664440  -25.492252   11.855634     1 15515 15516
15516 15515  H    -14.494128  -25.739719   11.447454     2 15514
15517 15516  H    -13.367878  -26.287690   12.297856     2 15514
15518 15517  O      0.173760   11.796535  -15.649328     1 15518 15519
15519 15518  H      0.960776   11.523486  -15.177861     2 15517
15520 15519  H     -0.395462   12.164338  -14.973355     2 15517
15521 15520  O     27.592283    6.154871   -6.703492     1 15521 15522
15522 15521  H     28.343221    6.029493   -6.123316     2 15520
15523 15522  H     26.888755    6.449518   -6.125165     2 15520
15524 15523  O    -14.680683   -7.045171   31.862129     1 15524 15525
15525 15524  H    -14.442692   -7.827983   31.365342     2 15523
15526 15525  H    -15.543848   -6.801804   31.527540     2 15523
15527 15526  O     29.223265    9.669784   -1.811025     1 15527 15528
15528 15527  H     29.093272    9.211777   -0.980626     2 15526
15529 15528  H     28.614958   10.407989   -1.775727     2 15526
15530 15529  O      8.322260    5.975960  -11.460189     1 15530 15531
15531 15530  H      7.535019    6.200868  -11.956072     2 15529
15532 15531  H      8.933785    6.688936  -11.644400     2 15529
15533 15532  O     32.534403    7.674277    1.186895     1 15533 15534
15534 15533  H     31.867056    7.348662    0.582864     2 15532
15535 15534  H     32.856047    8.478041    0.778556     2 15532
15536 15535  O      7.866231   24.013389   -8.106633     1 15536 15537
15537 15536  H      7.993038   23.474916   -7.325481     2 15535
15538 15537  H      6.919034   24.016771   -8.244613     2 15535
15539 15538  O      4.970015   12.606133  -12.716310     1 15539 15540
15540 15539  H      5.789411   12.898927  -13.115176     2 15538
15541 15540  H      4.286724   13.052448  -13.216458     2 15538
15542 15541  O     12.383379    7.330248  -15.318664     1 15542 15543
15543 15542  H     13.242358    7.691165  -15.538041     2 15541
15544 15543  H     12.230357    6.655751  -15.980382     2 15541
15545 15544  O    -20.497160  -24.769691    7.632286     1 15545 15546
15546 15545  H    -20.755742  -24.174353    8.335806     2 15544
15547 15546  H    -19.663915  -25.139104    7.924633     2 15544
15548 15547  O      5.153002    9.298459   -2.438822     1 15548 15549
15549 15548  H      5.752093    9.908832   -2.008979     2 15547
15550 15549  H      5.621213    8.463589   -2.440299     2 15547
15551 15550  O      9.020942   11.994098  -27.473369     1 15551 15552
15552 15551  H      8.686578   11.097651  -27.501931     2 15550
15553 15552  H      9.385748   12.142080  -28.345865     2 15550
15554 15553  O     25.152160   -0.428414  -19.882087     1 15554 15555
15555 15554  H     24.599909   -0.289010  -20.651384     2 15553
15556 15555  H     24.570313   -0.274174  -19.137845     2 15553
15557 15556  O    -27.978325  -16.714729    9.301628     1 15557 15558
15558 15557  H    -27.150502  -16.866599    8.845692     2 15556
15559 15558  H    -28.235677  -17.577849    9.625702     2 15556
15560 15559  O      7.718621   -0.532632   36.191560     1 15560 15561
15561 15560  H      6.768834   -0.448559   36.275627     2 15559
15562 15561  H      8.071539    0.142529   36.771075     2 15559
15563 15562  O      8.142269    6.847728   -8.626747     1 15563 15564
15564 15563  H      8.812627    7.530295   -8.595852     2 15562
15565 15564  H      8.178467    6.516243   -9.523987     2 15562
15566 15565  O     -7.585714  -27.214108    9.121650     1 15566 15567
15567 15566  H     -8.240584  -26.549237    9.334543     2 15565
15568 15567  H     -7.084133  -26.834547    8.400137     2 15565
15569 15568  O     27.491922    5.809838  -10.680586     1 15569 15570
15570 15569  H     28.362812    5.554581  -10.984929     2 15568
15571 15570  H     27.202668    5.076139  -10.138139     2 15568
15572 15571  O     13.384037   23.360753   -4.474518     1 15572 15573
15573 15572  H     13.914222   22.846114   -3.866010     2 15571
15574 15573  H     13.873269   24.175441   -4.589271     2 15571
15575 15574  O     -1.915317    7.448559  -22.115795     1 15575 15576
15576 15575  H     -1.901361    8.276710  -21.636000     2 15574
15577 15576  H     -2.489515    6.882187  -21.600285     2 15574
15578 15577  O     30.782915   17.770689   -3.551013     1 15578 15579
15579 15578  H     30.211197   17.370321   -4.206051     2 15577
15580 15579  H     31.632301   17.843665   -3.986270     2 15577
15581 15580  O      3.743890   25.244625  -14.616239     1 15581 15582
15582 15581  H      3.433935   24.688202  -15.330769     2 15580
15583 15582  H      4.532473   24.806766  -14.295853     2 15580
15584 15583  O     14.178050   29.781932   -6.618312     1 15584 15585
15585 15584  H     13.749396   29.539267   -5.797580     2 15583
15586 15585  H     15.042442   29.373932   -6.567379     2 15583
15587 15586  O     10.174708   12.241213  -21.575228     1 15587 15588
15588 15587  H     10.346101   12.335897  -22.512186     2 15586
15589 15588  H      9.489319   11.575091  -21.522745     2 15586
15590 15589  O      4.109912    7.466016   -8.153131     1 15590 15591
15591 15590  H      3.573033    7.908282   -8.810697     2 15589
15592 15591  H      4.867604    8.039266   -8.036860     2 15589
15593 15592  O     26.556021    4.294821   -8.322640     1 15593 15594
15594 15593  H     25.606033    4.198644   -8.255528     2 15592
15595 15594  H     26.777884    4.952079   -7.663080     2 15592
15596 15595  O      6.664769    8.071888  -15.014647     1 15596 15597
15597 15596  H      7.153662    8.850905  -14.749413     2 15595
15598 15597  H      6.823375    7.997878  -15.955709     2 15595
15599 15598  O    -11.192448  -12.637765   25.144096     1 15599 15600
15600 15599  H    -10.508370  -12.397952   24.518988     2 15598
15601 15600  H    -11.698343  -13.316640   24.697518     2 15598
15602 15601  O      2.650104    8.190810   -2.172263     1 15602 15603
15603 15602  H      3.535725    8.206493   -2.535112     2 15601
15604 15603  H      2.128678    8.703796   -2.789670     2 15601
15605 15604  O     12.654291   11.274406  -13.394158     1 15605 15606
15606 15605  H     12.472169   12.204634  -13.260968     2 15604
15607 15606  H     11.807080   10.844740  -13.276469     2 15604
15608 15607  O      9.317133   23.748256  -17.668924     1 15608 15609
15609 15608  H      8.708534   23.040377  -17.880459     2 15607
15610 15609  H      9.478093   23.653832  -16.730091     2 15607
15611 15610  O     26.674234   12.670210   -8.096978     1 15611 15612
15612 15611  H     26.976700   12.309367   -8.930367     2 15610
15613 15612  H     27.302235   12.344285   -7.452293     2 15610
15614 15613  O     18.889958   13.301937   -8.321738     1 15614 15615
15615 15614  H     19.099305   14.211303   -8.108525     2 15613
15616 15615  H     18.078490   13.124598   -7.846026     2 15613
15617 15616  O     -1.565117   32.872705    0.778277     1 15617 15618
15618 15617  H     -1.314954   33.186930    1.647134     2 15616
15619 15618  H     -1.376197   31.934557    0.798779     2 15616
15620 15619  O      4.759278   11.747820    1.811769     1 15620 15621
15621 15620  H      4.241200   11.309986    2.487142     2 15619
15622 15621  H      4.613587   11.226811    1.022115     2 15619
15623 15622  O     30.365636    3.451411  -18.314355     1 15623 15624
15624 15623  H     30.919333    3.357405  -17.539233     2 15622
15625 15624  H     29.564621    3.861989  -17.988728     2 15622
15626 15625  O     17.968860    1.487589  -23.929218     1 15626 15627
15627 15626  H     18.689608    2.022006  -24.262614     2 15625
15628 15627  H     17.545533    1.139182  -24.713844     2 15625
15629 15628  O    -15.796157   -6.536161  -26.355472     1 15629 15630
15630 15629  H    -14.950335   -6.139898  -26.564740     2 15628
15631 15630  H    -16.264005   -6.558102  -27.190258     2 15628
15632 15631  O      1.352169   33.292145  -17.564959     1 15632 15633
15633 15632  H      1.027459   33.688775  -16.756579     2 15631
15634 15633  H      0.586386   32.862337  -17.945843     2 15631
15635 15634  O     21.085098   -1.077701  -25.361524     1 15635 15636
15636 15635  H     21.666778   -1.832240  -25.269053     2 15634
15637 15636  H     20.949522   -0.993436  -26.305319     2 15634
15638 15637  O     30.643963    5.046111  -11.114293     1 15638 15639
15639 15638  H     30.982642    5.018790  -10.219429     2 15637
15640 15639  H     30.559098    4.126766  -11.366947     2 15637
15641 15640  O      4.259758  -36.110664   -5.760063     1 15641 15642
15642 15641  H      5.072157  -35.605132   -5.734070     2 15640
15643 15642  H      4.026808  -36.143006   -6.687921     2 15640
15644 15643  O      5.086957   -1.467240   34.429305     1 15644 15645
15645 15644  H      5.156486   -0.663415   34.944343     2 15643
15646 15645  H      4.642851   -2.086050   35.009025     2 15643
15647 15646  O      2.610557    1.722159  -26.817833     1 15647 15648
15648 15647  H      2.477766    1.178767  -27.594573     2 15646
15649 15648  H      2.871457    1.104573  -26.134642     2 15646
15650 15649  O     12.475355   16.460416   -5.415492     1 15650 15651
15651 15650  H     12.754368   17.059628   -6.107827     2 15649
15652 15651  H     11.608586   16.162157   -5.691144     2 15649
15653 15652  O     14.746592    6.729870   -0.784268     1 15653 15654
15654 15653  H     14.927077    5.796753   -0.898063     2 15652
15655 15654  H     15.051078    7.134033   -1.596778     2 15652
15656 15655  O     21.249870   12.231110   -6.726683     1 15656 15657
15657 15656  H     21.712342   12.961129   -7.138294     2 15655
15658 15657  H     21.198693   11.563290   -7.410517     2 15655
15659 15658  O     -7.148473  -29.647277   13.051974     1 15659 15660
15660 15659  H     -7.802705  -29.273575   13.642363     2 15658
15661 15660  H     -6.506152  -30.055082   13.632792     2 15658
15662 15661  O      4.963142   14.084812  -16.516210     1 15662 15663
15663 15662  H      5.653327   13.786553  -17.108594     2 15661
15664 15663  H      4.303209   13.392231  -16.548607     2 15661
15665 15664  O      3.441034   35.950168  -14.006916     1 15665 15666
15666 15665  H      3.758437   35.094884  -14.296704     2 15664
15667 15666  H      2.844698   35.752736  -13.284673     2 15664
15668 15667  O    -34.969802  -13.244769    1.226921     1 15668 15669
15669 15668  H    -35.847273  -13.579380    1.412153     2 15667
15670 15669  H    -35.091636  -12.647143    0.489201     2 15667
15671 15670  O      1.696994    9.703258   -4.290443     1 15671 15672
15672 15671  H      2.096792    9.245621   -5.030011     2 15670
15673 15672  H      0.758733    9.539479   -4.385698     2 15670
15674 15673  O      8.755409   13.588695   -2.081094     1 15674 15675
15675 15674  H      9.048950   13.643465   -1.171663     2 15673
15676 15675  H      7.855867   13.915386   -2.063013     2 15673
15677 15676  O      0.871032    7.718835  -35.996745     1 15677 15678
15678 15677  H      0.123102    8.219623  -35.671104     2 15676
15679 15678  H      1.197795    8.229716  -36.737324     2 15676
15680 15679  O     23.731059    3.942293   -4.163241     1 15680 15681
15681 15680  H     22.865346    4.292579   -3.953309     2 15679
15682 15681  H     24.200503    3.946775   -3.329075     2 15679
15683 15682  O     20.275183   24.440857   -9.444840     1 15683 15684
15684 15683  H     19.419608   24.737770   -9.754783     2 15682
15685 15684  H     20.074248   23.782304   -8.779886     2 15682
15686 15685  O     12.817296    0.343782    1.190039     1 15686 15687
15687 15686  H     12.514133    1.211851    1.456083     2 15685
15688 15687  H     12.971255   -0.119428    2.013425     2 15685
15689 15688  O     21.415182   -2.792660   -5.213117     1 15689 15690
15690 15689  H     22.100178   -2.341657   -5.706685     2 15688
15691 15690  H     20.716927   -2.939696   -5.851123     2 15688
15692 15691  O      2.610295   14.703967  -19.966115     1 15692 15693
15693 15692  H      2.233334   13.919530  -19.567629     2 15691
15694 15693  H      1.863366   15.156968  -20.357417     2 15691
15695 15694  O    -34.381205  -16.150609    3.713375     1 15695 15696
15696 15695  H    -33.728940  -16.486115    4.328369     2 15694
15697 15696  H    -35.037544  -15.727389    4.266851     2 15694
15698 15697  O      4.861285    8.256441  -30.045654     1 15698 15699
15699 15698  H      5.770549    7.963232  -30.104810     2 15697
15700 15699  H      4.857643    9.114277  -30.470312     2 15697
15701 15700  O     24.914156   16.859876   -9.926925     1 15701 15702
15702 15701  H     25.388307   16.337333   -9.280115     2 15700
15703 15702  H     25.423804   17.666435  -10.004080     2 15700
15704 15703  O      7.731630  -35.786529   -5.184234     1 15704 15705
15705 15704  H      7.904926  -35.727371   -4.244713     2 15703
15706 15705  H      7.854517  -34.894026   -5.507603     2 15703
15707 15706  O     25.953068   15.795021   -2.401697     1 15707 15708
15708 15707  H     26.518871   15.090824   -2.718249     2 15706
15709 15708  H     25.128650   15.360550   -2.183058     2 15706
15710 15709  O     21.202039   11.625761   -0.467399     1 15710 15711
15711 15710  H     20.575973   10.903017   -0.511136     2 15709
15712 15711  H     20.832228   12.224689    0.181258     2 15709
15713 15712  O     32.255020   19.547822    0.375748     1 15713 15714
15714 15713  H     31.733603   20.068864   -0.234884     2 15712
15715 15714  H     32.876031   19.077022   -0.180063     2 15712
15716 15715  O      6.066719   13.801106   -5.046031     1 15716 15717
15717 15716  H      6.552283   13.096379   -4.617289     2 15715
15718 15717  H      5.470318   13.351798   -5.644912     2 15715
15719 15718  O     14.713993    2.302146    0.529490     1 15719 15720
15720 15719  H     13.940813    1.740597    0.473916     2 15718
15721 15720  H     15.437024    1.698743    0.700847     2 15718
15722 15721  O     20.623751    0.867936  -11.438135     1 15722 15723
15723 15722  H     20.597450    0.123373  -10.837165     2 15721
15724 15723  H     20.705194    0.472918  -12.306213     2 15721
15725 15724  O      5.265461   18.824741  -12.805293     1 15725 15726
15726 15725  H      4.917275   18.152803  -12.219207     2 15724
15727 15726  H      4.503671   19.133588  -13.295723     2 15724
15728 15727  O     20.127576   13.711619  -15.544318     1 15728 15729
15729 15728  H     20.211273   14.622329  -15.261772     2 15727
15730 15729  H     19.445577   13.730354  -16.215703     2 15727
15731 15730  O     34.924625    4.618160  -12.469946     1 15731 15732
15732 15731  H     35.387783    5.133045  -13.130711     2 15730
15733 15732  H     34.356695    4.035646  -12.974290     2 15730
15734 15733  O     28.103382   19.407074    0.006835     1 15734 15735
15735 15734  H     28.786720   19.164505    0.631689     2 15733
15736 15735  H     27.391294   19.745812    0.549438     2 15733
15737 15736  O     -7.331887   35.903850    9.530497     1 15737 15738
15738 15737  H     -7.360545   35.612317   10.441771     2 15736
15739 15738  H     -6.715991   36.636585    9.532199     2 15736
15740 15739  O     29.228597   -0.556869  -19.572605     1 15740 15741
15741 15740  H     29.974316    0.021620  -19.732247     2 15739
15742 15741  H     28.850468   -0.705693  -20.439266     2 15739
15743 15742  O     24.343797   -5.533193  -21.342282     1 15743 15744
15744 15743  H     24.191520   -4.766311  -20.790071     2 15742
15745 15744  H     23.488073   -5.727209  -21.724809     2 15742
15746 15745  O     16.973312    4.828916  -32.388112     1 15746 15747
15747 15746  H     17.790010    4.991026  -32.860296     2 15745
15748 15747  H     16.747258    5.675146  -32.002075     2 15745
15749 15748  O     14.708932    0.566441  -13.826218     1 15749 15750
15750 15749  H     14.205946    1.319068  -13.515108     2 15748
15751 15750  H     15.623041    0.838514  -13.744899     2 15748
15752 15751  O     25.101020    6.397762  -11.829015     1 15752 15753
15753 15752  H     25.028755    6.784734  -12.701519     2 15751
15754 15753  H     25.996248    6.594029  -11.552831     2 15751
15755 15754  O      4.899303    7.540157  -19.423478     1 15755 15756
15756 15755  H      4.490390    8.198520  -18.861713     2 15754
15757 15756  H      5.769380    7.409860  -19.046358     2 15754
15758 15757  O     21.167447   18.476183   -5.462270     1 15758 15759
15759 15758  H     20.785528   17.608134   -5.332423     2 15757
15760 15759  H     21.140616   18.882223   -4.595873     2 15757
15761 15760  O     14.931962   -4.799257    1.792322     1 15761 15762
15762 15761  H     14.150532   -4.346091    1.475717     2 15760
15763 15762  H     15.655474   -4.212632    1.571794     2 15760
15764 15763  O     -7.310246  -16.139585   27.937177     1 15764 15765
15765 15764  H     -8.042544  -16.098565   27.322126     2 15763
15766 15765  H     -7.699825  -15.938005   28.787957     2 15763
15767 15766  O     24.552078   -0.777196   -3.087399     1 15767 15768
15768 15767  H     23.995302   -0.844810   -2.311731     2 15766
15769 15768  H     25.107011   -1.556367   -3.053139     2 15766
15770 15769  O     25.706763    3.613201  -15.857826     1 15770 15771
15771 15770  H     26.544359    3.778199  -16.290771     2 15769
15772 15771  H     25.204391    3.103430  -16.493425     2 15769
15773 15772  O      2.389190   29.139802  -10.291402     1 15773 15774
15774 15773  H      3.072302   28.640352   -9.844032     2 15772
15775 15774  H      1.959375   29.635908   -9.594718     2 15772
15776 15775  O     30.021258   14.712414   -7.707501     1 15776 15777
15777 15776  H     30.952920   14.493278   -7.692745     2 15775
15778 15777  H     29.978933   15.549628   -8.169576     2 15775
15779 15778  O      5.811224   10.538055   -5.516356     1 15779 15780
15780 15779  H      6.283281   10.852041   -4.745119     2 15778
15781 15780  H      6.077475    9.622873   -5.604587     2 15778
15782 15781  O     -3.025881   13.688364  -24.540594     1 15782 15783
15783 15782  H     -2.514986   12.879993  -24.498700     2 15781
15784 15783  H     -3.524313   13.615342  -25.354514     2 15781
15785 15784  O    -14.321387  -28.453018   11.504761     1 15785 15786
15786 15785  H    -13.684120  -28.535050   10.795260     2 15784
15787 15786  H    -13.792012  -28.436302   12.302079     2 15784
15788 15787  O     24.172464   10.903175  -13.678823     1 15788 15789
15789 15788  H     24.732855   11.393384  -13.077251     2 15787
15790 15789  H     23.480197   11.519451  -13.917995     2 15787
15791 15790  O     28.240844    9.350448   -7.191928     1 15791 15792
15792 15791  H     28.752646   10.102814   -7.488974     2 15790
15793 15792  H     28.294935    9.385390   -6.236896     2 15790
15794 15793  O      2.487344    1.462353    2.689386     1 15794 15795
15795 15794  H      1.555745    1.244862    2.656960     2 15793
15796 15795  H      2.508107    2.405183    2.853314     2 15793
15797 15796  O     12.904560   20.023030  -10.850120     1 15797 15798
15798 15797  H     12.681035   19.099913  -10.731277     2 15796
15799 15798  H     12.064902   20.480647  -10.807770     2 15796
15800 15799  O     29.452972   -3.120255  -18.088941     1 15800 15801
15801 15800  H     29.253213   -3.728018  -18.800946     2 15799
15802 15801  H     29.340153   -2.252008  -18.475787     2 15799
15803 15802  O     30.735839    6.778503   -0.712896     1 15803 15804
15804 15803  H     30.824039    6.655059   -1.657996     2 15802
15805 15804  H     30.801854    5.895888   -0.348392     2 15802
15806 15805  O      0.185935  -29.949222   22.590094     1 15806 15807
15807 15806  H     -0.235759  -29.273255   23.120635     2 15805
15808 15807  H      1.093798  -29.960609   22.893223     2 15805
15809 15808  O     35.382497    5.332995   -9.877568     1 15809 15810
15810 15809  H     36.126028    4.730314   -9.864583     2 15808
15811 15810  H     35.037382    5.269194  -10.768106     2 15808
15812 15811  O     34.897228    2.629632  -16.258082     1 15812 15813
15813 15812  H     34.857473    2.232195  -15.388199     2 15811
15814 15813  H     33.987529    2.842237  -16.466597     2 15811
15815 15814  O     -0.340090  -31.331254   19.596981     1 15815 15816
15816 15815  H      0.127965  -31.105207   20.400759     2 15814
15817 15816  H     -0.474237  -32.277209   19.655335     2 15814
15818 15817  O     -2.549323    6.122354  -15.359185     1 15818 15819
15819 15818  H     -3.005253    6.876266  -14.985052     2 15817
15820 15819  H     -1.846381    5.934168  -14.737340     2 15817
15821 15820  O     23.974990   12.043282  -10.362715     1 15821 15822
15822 15821  H     24.748414   12.465039   -9.988324     2 15820
15823 15822  H     23.236371   12.537579  -10.007266     2 15820
15824 15823  O     29.039210    3.351722   -5.169900     1 15824 15825
15825 15824  H     29.083615    2.951236   -6.038157     2 15823
15826 15825  H     28.348512    2.867605   -4.717353     2 15823
15827 15826  O     28.299802    4.363697   -1.568829     1 15827 15828
15828 15827  H     28.731017    4.714948   -0.789786     2 15826
15829 15828  H     28.966895    3.819903   -1.987765     2 15826
15830 15829  O     -4.436720   24.226186   -4.493169     1 15830 15831
15831 15830  H     -4.153817   23.818070   -3.674854     2 15829
15832 15831  H     -3.624019   24.400674   -4.967828     2 15829
15833 15832  O      7.349035   31.668114    2.781956     1 15833 15834
15834 15833  H      7.678149   32.195249    2.053915     2 15832
15835 15834  H      8.109493   31.540999    3.349211     2 15832
15836 15835  O     25.133260   19.782054   -5.245797     1 15836 15837
15837 15836  H     24.298295   19.622477   -4.805796     2 15835
15838 15837  H     25.639299   18.983238   -5.097304     2 15835
15839 15838  O     28.307071   12.314707    0.204628     1 15839 15840
15840 15839  H     27.883196   12.378336   -0.651241     2 15838
15841 15840  H     29.189378   12.657176    0.061521     2 15838
15842 15841  O     24.774299   13.460449   -4.912908     1 15842 15843
15843 15842  H     24.407027   14.099775   -5.523321     2 15841
15844 15843  H     25.012632   12.713630   -5.462172     2 15841
15845 15844  O     -2.792332   16.472042  -33.739625     1 15845 15846
15846 15845  H     -2.997267   16.804284  -32.865641     2 15844
15847 15846  H     -3.644058   16.376437  -34.165834     2 15844
15848 15847  O     24.265438   -4.175627  -15.993210     1 15848 15849
15849 15848  H     24.688708   -4.773365  -16.609476     2 15847
15850 15849  H     24.687147   -3.330799  -16.150241     2 15847
15851 15850  O    -10.393497  -15.988030   25.132007     1 15851 15852
15852 15851  H    -11.181292  -15.655206   24.702077     2 15850
15853 15852  H     -9.670659  -15.560104   24.673077     2 15850
15854 15853  O     16.684176    8.838019  -14.474911     1 15854 15855
15855 15854  H     16.066144    9.137861  -13.808305     2 15853
15856 15855  H     17.377957    9.497485  -14.472920     2 15853
15857 15856  O      1.445757   18.711774  -22.957297     1 15857 15858
15858 15857  H      1.959411   18.118939  -23.505875     2 15856
15859 15858  H      0.637328   18.854346  -23.449585     2 15856
15860 15859  O      2.823370   27.242474   -1.766127     1 15860 15861
15861 15860  H      3.480917   27.891654   -2.015986     2 15859
15862 15861  H      2.214625   27.221020   -2.504504     2 15859
15863 15862  O      2.014022    1.332827   -3.105039     1 15863 15864
15864 15863  H      2.256171    0.536786   -3.578234     2 15862
15865 15864  H      2.423802    1.235126   -2.245524     2 15862
15866 15865  O     22.363077   13.584060   -8.876497     1 15866 15867
15867 15866  H     22.706397   14.405474   -8.524869     2 15865
15868 15867  H     21.606036   13.845259   -9.400804     2 15865
15869 15868  O     20.358161   16.065172   -4.463375     1 15869 15870
15870 15869  H     20.057637   16.369337   -3.606987     2 15868
15871 15870  H     20.451304   15.117873   -4.362473     2 15868
15872 15871  O     31.847176    2.029691  -16.326756     1 15872 15873
15873 15872  H     30.989203    1.661895  -16.115000     2 15871
15874 15873  H     32.058625    1.665991  -17.186548     2 15871
15875 15874  O     27.833793   14.481936   -3.844690     1 15875 15876
15876 15875  H     28.303723   15.263292   -4.136032     2 15874
15877 15876  H     27.772589   13.933202   -4.626595     2 15874
15878 15877  O     20.579716    5.128045  -18.031538     1 15878 15879
15879 15878  H     21.062681    4.490050  -18.556837     2 15877
15880 15879  H     19.913252    5.472879  -18.625801     2 15877
15881 15880  O     -7.405341  -29.377955   16.403573     1 15881 15882
15882 15881  H     -7.493484  -29.107100   17.317410     2 15880
15883 15882  H     -7.969844  -28.775509   15.919189     2 15880
15884 15883  O     17.623537   11.462531  -24.835677     1 15884 15885
15885 15884  H     17.645099   11.138453  -23.935266     2 15883
15886 15885  H     17.249951   10.740916  -25.341579     2 15883
15887 15886  O     -1.118193   12.184103  -13.345862     1 15887 15888
15888 15887  H     -1.843407   11.661888  -13.002950     2 15886
15889 15888  H     -0.856158   12.741324  -12.613009     2 15886
15890 15889  O     21.977994    8.627453  -18.052544     1 15890 15891
15891 15890  H     22.198225    8.066410  -18.796157     2 15889
15892 15891  H     21.940269    9.510175  -18.420797     2 15889
15893 15892  O     -2.599828    8.071272   35.303712     1 15893 15894
15894 15893  H     -3.332639    7.712710   34.803061     2 15892
15895 15894  H     -2.721157    9.019783   35.260824     2 15892
15896 15895  O     17.924650    7.471434  -24.344970     1 15896 15897
15897 15896  H     18.495481    8.169173  -24.023188     2 15895
15898 15897  H     17.039702    7.768572  -24.133290     2 15895
15899 15898  O      4.093791    5.440484  -13.595857     1 15899 15900
15900 15899  H      4.031070    5.307640  -14.541716     2 15898
15901 15900  H      3.220063    5.231196  -13.265660     2 15898
15902 15901  O     16.066677   -4.366548  -10.510640     1 15902 15903
15903 15902  H     15.934918   -4.620722   -9.597258     2 15901
15904 15903  H     15.187563   -4.169862  -10.834222     2 15901
15905 15904  O      7.464766    7.329715  -18.302922     1 15905 15906
15906 15905  H      8.053738    6.920909  -18.937131     2 15904
15907 15906  H      7.815668    8.212263  -18.183724     2 15904
15908 15907  O     -3.912691  -22.923607   25.307797     1 15908 15909
15909 15908  H     -3.462344  -22.356184   25.933456     2 15907
15910 15909  H     -3.881385  -23.793155   25.706717     2 15907
15911 15910  O     13.262861    3.758446   -5.143193     1 15911 15912
15912 15911  H     12.417312    3.493862   -4.780875     2 15910
15913 15912  H     13.098976    3.867667   -6.079913     2 15910
15914 15913  O     22.231955    8.234070   -0.691491     1 15914 15915
15915 15914  H     21.434197    8.584709   -0.295429     2 15913
15916 15915  H     22.940355    8.737533   -0.290335     2 15913
15917 15916  O      0.413836   13.894468  -17.762079     1 15917 15918
15918 15917  H      0.001574   13.450505  -18.503137     2 15916
15919 15918  H      0.465028   13.225226  -17.079636     2 15916
15920 15919  O     22.416876   12.671523  -14.181532     1 15920 15921
15921 15920  H     21.754541   12.884487  -14.838944     2 15919
15922 15921  H     22.325886   13.356059  -13.518686     2 15919
15923 15922  O     34.018354    7.689949  -10.135621     1 15923 15924
15924 15923  H     33.936766    7.960923   -9.221209     2 15922
15925 15924  H     34.507423    6.867912  -10.099601     2 15922
15926 15925  O     29.123742    7.384245  -17.155435     1 15926 15927
15927 15926  H     28.624657    8.174065  -16.947279     2 15925
15928 15927  H     29.964407    7.508509  -16.714898     2 15925
15929 15928  O     24.419618    9.350545  -10.566473     1 15929 15930
15930 15929  H     24.656252   10.271247  -10.678473     2 15928
15931 15930  H     25.162163    8.966961  -10.099866     2 15928
15932 15931  O      5.215094    7.162171   34.316685     1 15932 15933
15933 15932  H      4.849258    6.605820   35.004339     2 15931
15934 15933  H      4.478985    7.332863   33.729114     2 15931
15935 15934  O     23.039059   21.029096    3.010433     1 15935 15936
15936 15935  H     22.415905   21.542841    3.524219     2 15934
15937 15936  H     23.654992   21.675005    2.664515     2 15934
15938 15937  O      6.650380   33.012665  -10.329381     1 15938 15939
15939 15938  H      7.221338   32.510482   -9.747960     2 15937
15940 15939  H      5.847106   32.494861  -10.382892     2 15937
15941 15940  O      2.840516   35.158619   -0.981012     1 15941 15942
15942 15941  H      2.745841   36.100321   -1.124069     2 15940
15943 15942  H      3.763035   34.979751   -1.163207     2 15940
15944 15943  O     10.231174    3.127706  -19.516672     1 15944 15945
15945 15944  H     10.359077    2.465904  -18.837047     2 15943
15946 15945  H      9.998102    2.626952  -20.298435     2 15943
15947 15946  O      1.555603   11.998164  -19.587842     1 15947 15948
15948 15947  H      1.539733   11.054157  -19.430265     2 15946
15949 15948  H      1.195001   12.100549  -20.468589     2 15946
15950 15949  O     29.238658    1.101264  -15.877427     1 15950 15951
15951 15950  H     28.520565    0.468449  -15.888261     2 15949
15952 15951  H     29.158318    1.569663  -16.708318     2 15949
15953 15952  O     20.197429   -3.481161  -13.928700     1 15953 15954
15954 15953  H     20.020672   -3.001504  -14.737969     2 15952
15955 15954  H     19.367516   -3.461872  -13.452144     2 15952
15956 15955  O      0.529979   18.184801  -20.508936     1 15956 15957
15957 15956  H      1.051875   18.600161  -19.822400     2 15955
15958 15957  H      1.019297   18.349261  -21.315009     2 15955
15959 15958  O     12.648748    4.044043  -20.402405     1 15959 15960
15960 15959  H     11.778166    3.700564  -20.201554     2 15958
15961 15960  H     12.864118    3.667905  -21.255849     2 15958
15962 15961  O     15.186080   19.660428   -5.968245     1 15962 15963
15963 15962  H     14.423072   19.784208   -6.532805     2 15961
15964 15963  H     15.886621   19.398405   -6.565589     2 15961
15965 15964  O      0.620534   13.905579   -8.086449     1 15965 15966
15966 15965  H      1.102512   13.882538   -7.259770     2 15964
15967 15966  H      1.219072   13.516557   -8.724136     2 15964
15968 15967  O     19.257523   17.589580  -12.434395     1 15968 15969
15969 15968  H     18.674250   16.852230  -12.614226     2 15967
15970 15969  H     19.231390   17.689713  -11.482806     2 15967
15971 15970  O     20.726216    5.158799  -21.396679     1 15971 15972
15972 15971  H     20.592415    5.097044  -22.342467     2 15970
15973 15972  H     21.158408    4.337792  -21.161330     2 15970
15974 15973  O     14.289310   29.047282   -2.224000     1 15974 15975
15975 15974  H     14.907254   28.317006   -2.256767     2 15973
15976 15975  H     13.686836   28.884610   -2.949806     2 15973
15977 15976  O      3.122629   23.002334    1.921161     1 15977 15978
15978 15977  H      3.563533   23.848632    1.846225     2 15976
15979 15978  H      2.282574   23.129513    1.480293     2 15976
15980 15979  O      2.152937   24.849908  -26.074920     1 15980 15981
15981 15980  H      1.745003   24.682303  -25.225373     2 15979
15982 15981  H      3.026806   24.466269  -26.001391     2 15979
15983 15982  O    -30.189317  -10.396158   10.970149     1 15983 15984
15984 15983  H    -29.432027   -9.893708   10.669669     2 15982
15985 15984  H    -30.086597  -11.254262   10.558643     2 15982
15986 15985  O      8.530696   29.324628   -2.478557     1 15986 15987
15987 15986  H      8.446415   29.235773   -1.529224     2 15985
15988 15987  H      7.804164   29.894087   -2.731734     2 15985
15989 15988  O      0.410244    5.919287  -19.759780     1 15989 15990
15990 15989  H      0.781710    6.227067  -20.586530     2 15988
15991 15990  H     -0.035192    6.684943  -19.397028     2 15988
15992 15991  O     22.112749   13.451003  -17.717590     1 15992 15993
15993 15992  H     22.283983   13.926457  -18.530520     2 15991
15994 15993  H     21.269233   13.787942  -17.415625     2 15991
15995 15994  O     22.908244   15.093525   -6.403565     1 15995 15996
15996 15995  H     22.671626   16.007427   -6.561761     2 15994
15997 15996  H     22.249854   14.778940   -5.784056     2 15994
15998 15997  O    -34.685926    2.323190   -6.553550     1 15998 15999
15999 15998  H    -35.624551    2.421963   -6.713110     2 15997
16000 15999  H    -34.272568    2.923969   -7.173575     2 15997
16001 16000  O     -3.731045    4.018637  -18.933435     1 16001 16002
16002 16001  H     -2.993950    3.463501  -19.187887     2 16000
16003 16002  H     -3.745668    4.714308  -19.590748     2 16000
16004 16003  O      6.103750   26.241427  -17.153080     1 16004 16005
16005 16004  H      6.455390   27.097178  -16.907579     2 16003
16006 16005  H      5.155876   26.371204  -17.183474     2 16003
16007 16006  O      8.964448   27.187616    0.548732     1 16007 16008
16008 16007  H      9.687278   26.803353    1.044808     2 16006
16009 16008  H      9.167882   26.988332   -0.365124     2 16006
16010 16009  O     25.753217    4.778874   -2.609422     1 16010 16011
16011 16010  H     26.589903    4.853286   -2.150453     2 16009
16012 16011  H     25.449991    5.681882   -2.703559     2 16009
16013 16012  O      8.893249   30.425250   -8.219060     1 16013 16014
16014 16013  H      7.987444   30.434283   -7.909759     2 16012
16015 16014  H      8.991931   29.575214   -8.647933     2 16012
16016 16015  O      3.841729   21.881620  -17.033468     1 16016 16017
16017 16016  H      3.488504   22.137295  -17.885579     2 16015
16018 16017  H      3.169658   22.146983  -16.405668     2 16015
16019 16018  O      7.359723   17.198970  -18.844061     1 16019 16020
16020 16019  H      6.586076   17.557344  -18.409008     2 16018
16021 16020  H      7.079711   16.341151  -19.163392     2 16018
16022 16021  O      4.016159    5.088494  -33.755863     1 16022 16023
16023 16022  H      4.072834    5.608165  -32.954014     2 16021
16024 16023  H      4.682602    4.409689  -33.649522     2 16021
16025 16024  O      7.675091    2.934053    7.488465     1 16025 16026
16026 16025  H      8.324498    3.182142    6.830474     2 16024
16027 16026  H      7.366296    2.072537    7.207990     2 16024
16028 16027  O      6.305826    5.419617  -27.896736     1 16028 16029
16029 16028  H      5.999551    4.513730  -27.854368     2 16027
16030 16029  H      6.617106    5.609351  -27.011673     2 16027
16031 16030  O     12.121746   24.162070  -10.909733     1 16031 16032
16032 16031  H     11.320117   24.618434  -10.654087     2 16030
16033 16032  H     12.472311   24.680299  -11.634147     2 16030
16034 16033  O      9.260247   16.401897   -9.359834     1 16034 16035
16035 16034  H      8.819239   15.993814  -10.104960     2 16033
16036 16035  H      8.684715   16.227162   -8.615213     2 16033
16037 16036  O     18.455201   17.799494   -9.884688     1 16037 16038
16038 16037  H     18.708288   17.085331   -9.299752     2 16036
16039 16038  H     18.759944   18.591637   -9.442113     2 16036
16040 16039  O     -7.735374    0.898634  -27.071579     1 16040 16041
16041 16040  H     -7.610892    0.688541  -26.146053     2 16039
16042 16041  H     -8.353934    0.239386  -27.386232     2 16039
16043 16042  O     24.620111   19.299374   -8.150399     1 16043 16044
16044 16043  H     23.666469   19.228703   -8.192877     2 16042
16045 16044  H     24.839509   19.049760   -7.252742     2 16042
16046 16045  O     -1.644203   31.168540   -5.200755     1 16046 16047
16047 16046  H     -1.608067   30.460277   -5.843631     2 16045
16048 16047  H     -0.839778   31.666374   -5.346681     2 16045
16049 16048  O      8.192682   26.969496   -7.755648     1 16049 16050
16050 16049  H      9.101487   27.269950   -7.761551     2 16048
16051 16050  H      8.252059   26.022809   -7.884058     2 16048
16052 16051  O     23.119069   22.536211   -6.021225     1 16052 16053
16053 16052  H     22.996522   22.954181   -6.873583     2 16051
16054 16053  H     22.555369   21.763127   -6.049769     2 16051
16055 16054  O     -4.748747  -15.727034   31.515836     1 16055 16056
16056 16055  H     -5.367550  -16.394787   31.811505     2 16054
16057 16056  H     -4.380526  -15.366988   32.322689     2 16054
16058 16057  O      4.442955   25.441260    1.873465     1 16058 16059
16059 16058  H      3.828577   25.806604    2.510092     2 16057
16060 16059  H      5.294631   25.792906    2.132743     2 16057
16061 16060  O     10.400563    7.730338  -30.034360     1 16061 16062
16062 16061  H      9.923245    7.518699  -30.836612     2 16060
16063 16062  H     10.915326    6.945340  -29.847202     2 16060
16064 16063  O     16.524018    7.213084  -30.481708     1 16064 16065
16065 16064  H     15.725760    7.544978  -30.070780     2 16063
16066 16065  H     16.772958    7.893791  -31.106926     2 16063
16067 16066  O      1.520240   22.847543  -18.967033     1 16067 16068
16068 16067  H      1.586646   22.074810  -19.528018     2 16066
16069 16068  H      2.211498   23.431195  -19.279675     2 16066
16070 16069  O      2.990574   20.537774  -12.898941     1 16070 16071
16071 16070  H      2.243412   20.366992  -12.325518     2 16069
16072 16071  H      3.507070   21.193981  -12.431122     2 16069
16073 16072  O      7.569241    9.967619   -0.524528     1 16073 16074
16074 16073  H      7.568992   10.915946   -0.654562     2 16072
16075 16074  H      8.495845    9.731803   -0.479504     2 16072
16076 16075  O      4.038124   23.468436  -19.624165     1 16076 16077
16077 16076  H      4.102626   24.348228  -19.252632     2 16075
16078 16077  H      4.191316   23.591704  -20.560952     2 16075
16079 16078  O      8.433148    4.415446  -30.047478     1 16079 16080
16080 16079  H      8.214102    4.453208  -29.116445     2 16078
16081 16080  H      9.388886    4.366432  -30.067364     2 16078
16082 16081  O     32.360329   -0.809998   -0.069937     1 16082 16083
16083 16082  H     32.887635   -0.161092    0.396004     2 16081
16084 16083  H     31.723808   -0.292562   -0.563224     2 16081
16085 16084  O     14.854104   29.420609    0.703177     1 16085 16086
16086 16085  H     14.502799   29.259435   -0.172516     2 16084
16087 16086  H     15.564378   28.785890    0.797381     2 16084
16088 16087  O     20.683551   21.068214   -2.612398     1 16088 16089
16089 16088  H     20.095524   20.628357   -1.998411     2 16087
16090 16089  H     20.568987   22.000540   -2.428342     2 16087
16091 16090  O     17.078981   31.455271   -1.271616     1 16091 16092
16092 16091  H     17.760424   31.217979   -1.900551     2 16090
16093 16092  H     17.359131   31.051168   -0.450368     2 16090
16094 16093  O      4.703876   -3.073888   -0.837554     1 16094 16095
16095 16094  H      4.413938   -3.750894   -0.226137     2 16093
16096 16095  H      5.567295   -3.367199   -1.128600     2 16093
16097 16096  O      2.447304   30.582029   -7.793162     1 16097 16098
16098 16097  H      2.616340   31.081782   -6.994473     2 16096
16099 16098  H      2.021745   29.780359   -7.489094     2 16096
16100 16099  O      2.099840   26.153700  -20.234101     1 16100 16101
16101 16100  H      1.733455   26.681566  -20.943574     2 16099
16102 16101  H      3.029797   26.077140  -20.447526     2 16099
16103 16102  O     17.178580   31.674592   -5.486923     1 16103 16104
16104 16103  H     17.186081   30.955679   -4.854990     2 16102
16105 16104  H     16.256077   31.780052   -5.719511     2 16102
16106 16105  O     11.695153   13.838226  -17.836507     1 16106 16107
16107 16106  H     11.164144   14.577242  -18.133348     2 16105
16108 16107  H     11.065953   13.129733  -17.700949     2 16105
16109 16108  O      9.642820   25.013841  -10.192124     1 16109 16110
16110 16109  H      9.066796   24.641068   -9.524690     2 16108
16111 16110  H      9.074371   25.151931  -10.949771     2 16108
16112 16111  O     15.945355   22.682653   -7.686462     1 16112 16113
16113 16112  H     15.099958   23.007929   -7.995866     2 16111
16114 16113  H     15.801457   22.482153   -6.761624     2 16111
16115 16114  O     17.557507   16.536125  -16.389491     1 16115 16116
16116 16115  H     18.255123   17.010931  -16.841291     2 16114
16117 16116  H     16.756956   17.005717  -16.623657     2 16114
16118 16117  O      6.668534    0.195365  -33.795310     1 16118 16119
16119 16118  H      6.149074   -0.327984  -34.405636     2 16117
16120 16119  H      6.383223   -0.093424  -32.928460     2 16117
16121 16120  O      9.625023    8.902009  -23.625635     1 16121 16122
16122 16121  H      9.954146    8.262579  -22.993940     2 16120
16123 16122  H      8.915274    8.447581  -24.079488     2 16120
16124 16123  O    -33.273508  -18.605565    0.326422     1 16124 16125
16125 16124  H    -32.741593  -18.500996    1.115322     2 16123
16126 16125  H    -33.964308  -17.948780    0.413951     2 16123
16127 16126  O      5.797053   11.322055  -28.884759     1 16127 16128
16128 16127  H      6.602224   11.592932  -29.325845     2 16126
16129 16128  H      5.094577   11.696284  -29.416464     2 16126
16130 16129  O      6.341543    5.070041  -22.711569     1 16130 16131
16131 16130  H      5.870665    5.876544  -22.501667     2 16129
16132 16131  H      6.193282    4.501902  -21.955615     2 16129
16133 16132  O      7.464055   26.376276   -2.576331     1 16133 16134
16134 16133  H      8.398145   26.279233   -2.761509     2 16132
16135 16134  H      7.374770   27.274106   -2.256705     2 16132
16136 16135  O     19.881425   16.272179   -8.133868     1 16136 16137
16137 16136  H     20.677057   16.512252   -8.608806     2 16135
16138 16137  H     19.824503   16.910525   -7.422878     2 16135
16139 16138  O      8.158016   34.702391    1.892085     1 16139 16140
16140 16139  H      7.316130   35.136931    1.755582     2 16138
16141 16140  H      8.265646   34.680976    2.842973     2 16138
16142 16141  O     13.539860   -6.414425  -32.900940     1 16142 16143
16143 16142  H     12.758712   -5.909494  -32.674921     2 16141
16144 16143  H     13.757745   -6.890881  -32.099848     2 16141
16145 16144  O     19.232579   10.941527  -14.406059     1 16145 16146
16146 16145  H     20.111134   10.586110  -14.271701     2 16144
16147 16146  H     19.375253   11.762397  -14.877277     2 16144
16148 16147  O     15.442063   10.663781  -21.401191     1 16148 16149
16149 16148  H     15.484082   10.794597  -20.453903     2 16147
16150 16149  H     14.863716   11.359366  -21.714092     2 16147
16151 16150  O      0.680039    9.914251  -24.866872     1 16151 16152
16152 16151  H      0.441989    8.996381  -24.736191     2 16150
16153 16152  H      1.083606    9.936320  -25.734557     2 16150
16154 16153  O     15.576018    3.546527  -23.889651     1 16154 16155
16155 16154  H     15.823067    3.405579  -24.803616     2 16153
16156 16155  H     16.308984    3.192986  -23.385665     2 16153
16157 16156  O      6.563597  -35.405077    2.962960     1 16157 16158
16158 16157  H      6.554377  -35.286155    2.013220     2 16156
16159 16158  H      5.679221  -35.702847    3.176133     2 16156
16160 16159  O     13.791790   15.521211  -18.868928     1 16160 16161
16161 16160  H     13.391000   14.856402  -18.308903     2 16159
16162 16161  H     13.248833   16.299519  -18.743757     2 16159
16163 16162  O     -2.228143   20.733974   -5.041856     1 16163 16164
16164 16163  H     -2.320000   19.784703   -4.960131     2 16162
16165 16164  H     -2.103340   21.041195   -4.143930     2 16162
16166 16165  O      2.302722    1.610664   -8.005164     1 16166 16167
16167 16166  H      2.027128    0.754622   -8.332994     2 16165
16168 16167  H      3.223586    1.679095   -8.257272     2 16165
16169 16168  O     -1.103959    3.546167  -27.321220     1 16169 16170
16170 16169  H     -0.414519    4.177397  -27.527258     2 16168
16171 16170  H     -1.180400    3.577016  -26.367576     2 16168
16172 16171  O      5.889758   25.789503   -5.074663     1 16172 16173
16173 16172  H      6.321059   25.953561   -4.236035     2 16171
16174 16173  H      6.363518   26.338349   -5.699603     2 16171
16175 16174  O      5.760556   23.853811  -13.386265     1 16175 16176
16176 16175  H      6.525577   24.179756  -13.860327     2 16174
16177 16176  H      5.962168   22.935239  -13.207914     2 16174
16178 16177  O    -12.110432   -1.199183   30.775209     1 16178 16179
16179 16178  H    -12.319472   -0.605369   30.054155     2 16177
16180 16179  H    -12.951244   -1.363717   31.202052     2 16177
16181 16180  O    -14.993385   -6.085841   28.408500     1 16181 16182
16182 16181  H    -14.391353   -5.485097   27.969302     2 16180
16183 16182  H    -14.432294   -6.784592   28.744885     2 16180
16184 16183  O      0.790057   22.849430  -12.857419     1 16184 16185
16185 16184  H      0.701230   21.991754  -12.441806     2 16183
16186 16185  H     -0.077829   23.245384  -12.778515     2 16183
16187 16186  O     13.526345   23.457886   -8.648670     1 16187 16188
16188 16187  H     12.797479   23.759994   -8.106713     2 16186
16189 16188  H     13.131026   23.271425   -9.500249     2 16186
16190 16189  O      8.095765    9.428563  -27.733468     1 16190 16191
16191 16190  H      7.379731    9.361470  -28.365153     2 16189
16192 16191  H      8.818822    8.949686  -28.138555     2 16189
16193 16192  O     18.714369   -3.383043   -0.700210     1 16193 16194
16194 16193  H     19.054024   -3.837605    0.070659     2 16192
16195 16194  H     17.878171   -3.016014   -0.413339     2 16192
16196 16195  O     18.227646   -4.725297   -2.954481     1 16196 16197
16197 16196  H     18.185485   -4.307889   -2.094118     2 16195
16198 16197  H     18.004079   -4.027869   -3.570795     2 16195
16199 16198  O      6.550698   12.386299  -18.340436     1 16199 16200
16200 16199  H      6.725956   13.079402  -18.976929     2 16198
16201 16200  H      5.952934   11.790867  -18.792510     2 16198
16202 16201  O    -26.641599   -5.751516   16.645435     1 16202 16203
16203 16202  H    -26.881311   -5.430764   15.776017     2 16201
16204 16203  H    -26.388677   -4.965638   17.129850     2 16201
16205 16204  O      8.835789    1.357213  -21.372573     1 16205 16206
16206 16205  H      8.869274    0.400629  -21.380169     2 16204
16207 16206  H      7.994176    1.564671  -20.966520     2 16204
16208 16207  O     27.106263   -0.048891  -14.144225     1 16208 16209
16209 16208  H     26.331952    0.385442  -14.502035     2 16207
16210 16209  H     27.669540    0.667539  -13.851517     2 16207
16211 16210  O     12.732392   23.221128  -15.252206     1 16211 16212
16212 16211  H     11.847137   22.928104  -15.036126     2 16210
16213 16212  H     12.676093   23.501560  -16.165672     2 16210
16214 16213  O    -22.785757  -12.106182   18.256140     1 16214 16215
16215 16214  H    -22.418716  -11.453747   17.659616     2 16213
16216 16215  H    -23.378825  -12.623129   17.710917     2 16213
16217 16216  O      6.152323   20.616331  -16.330369     1 16217 16218
16218 16217  H      6.874230   21.062583  -16.773021     2 16216
16219 16218  H      5.405451   21.205750  -16.435253     2 16216
16220 16219  O     22.202418    2.853571  -11.004957     1 16220 16221
16221 16220  H     21.694726    2.127350  -11.367013     2 16219
16222 16221  H     21.853685    2.973296  -10.121620     2 16219
16223 16222  O     14.728208    5.805302  -25.053940     1 16223 16224
16224 16223  H     13.804004    5.904498  -24.825384     2 16222
16225 16224  H     15.019236    5.044107  -24.551828     2 16222
16226 16225  O     -2.486985   35.966159   -3.207419     1 16226 16227
16227 16226  H     -2.056619   35.178684   -2.874404     2 16225
16228 16227  H     -2.999691   36.290728   -2.467135     2 16225
16229 16228  O      2.352852    1.548286  -12.960571     1 16229 16230
16230 16229  H      1.723420    1.101649  -13.526754     2 16228
16231 16230  H      1.827301    1.880917  -12.232983     2 16228
16232 16231  O     -0.134698    2.161934  -30.903088     1 16232 16233
16233 16232  H     -0.196642    1.936431  -31.831282     2 16231
16234 16233  H      0.784348    2.013070  -30.680768     2 16231
16235 16234  O      6.430895   31.778873  -15.463376     1 16235 16236
16236 16235  H      6.773201   32.241296  -14.698377     2 16234
16237 16236  H      6.658895   32.339790  -16.204740     2 16234
16238 16237  O     11.695799   33.172312   -2.564365     1 16238 16239
16239 16238  H     12.578510   33.012386   -2.230484     2 16237
16240 16239  H     11.618607   34.126009   -2.591491     2 16237
16241 16240  O      9.764795    8.199792   35.699211     1 16241 16242
16242 16241  H      9.651046    7.291375   35.978625     2 16240
16243 16242  H      8.888194    8.482193   35.438344     2 16240
16244 16243  O     10.027275   19.235598    1.305230     1 16244 16245
16245 16244  H      9.743386   18.325948    1.395649     2 16243
16246 16245  H      9.242505   19.751447    1.490347     2 16243
16247 16246  O      7.532818   22.325485  -11.094593     1 16247 16248
16248 16247  H      7.182513   21.921693  -11.888615     2 16246
16249 16248  H      8.402367   21.938662  -10.992197     2 16246
16250 16249  O     17.804940    0.212849  -13.007104     1 16250 16251
16251 16250  H     17.771901   -0.247565  -12.168558     2 16249
16252 16251  H     18.469223   -0.255941  -13.512272     2 16249
16253 16252  O      5.707980   28.920110  -15.805146     1 16253 16254
16254 16253  H      5.660170   29.097927  -16.744468     2 16252
16255 16254  H      6.173241   29.673524  -15.441648     2 16252
16256 16255  O     29.437772    2.041575   -8.053380     1 16256 16257
16257 16256  H     28.675333    1.794534   -7.530035     2 16255
16258 16257  H     29.721012    1.225163   -8.465057     2 16255
16259 16258  O      6.176927    6.951727  -12.651868     1 16259 16260
16260 16259  H      6.432669    7.181811  -13.545114     2 16258
16261 16260  H      5.411088    6.387644  -12.759260     2 16258
16262 16261  O     10.678836   28.301984   -7.333143     1 16262 16263
16263 16262  H     10.486322   28.841649   -6.566377     2 16261
16264 16263  H     11.266289   28.839978   -7.863892     2 16261
16265 16264  O     28.229369    4.617108  -17.097955     1 16265 16266
16266 16265  H     28.625157    4.526140  -16.231175     2 16264
16267 16266  H     28.251033    5.557701  -17.274155     2 16264
16268 16267  O    -26.033966  -14.830434   10.556547     1 16268 16269
16269 16268  H    -26.733230  -15.137641    9.979584     2 16267
16270 16269  H    -25.588342  -15.628845   10.839727     2 16267
16271 16270  O    -16.972514  -19.807130   17.404080     1 16271 16272
16272 16271  H    -16.778454  -19.000013   17.880666     2 16270
16273 16272  H    -16.899609  -19.564259   16.481079     2 16270
16274 16273  O     13.798448   25.174781  -12.842101     1 16274 16275
16275 16274  H     13.533279   24.340541  -13.229347     2 16273
16276 16275  H     14.446663   25.527170  -13.451912     2 16273
16277 16276  O      4.804187   29.158560   -4.978838     1 16277 16278
16278 16277  H      5.154385   28.789767   -5.789755     2 16276
16279 16278  H      5.418680   29.854843   -4.746846     2 16276
16280 16279  O      4.245397   30.204995    0.653360     1 16280 16281
16281 16280  H      3.429713   29.719149    0.531522     2 16279
16282 16281  H      4.365196   30.682535   -0.167515     2 16279
16283 16282  O      7.173985   24.973615    5.617819     1 16283 16284
16284 16283  H      6.644506   24.180587    5.534214     2 16282
16285 16284  H      6.537198   25.672908    5.765203     2 16282
16286 16285  O     15.712052   19.394472  -11.344307     1 16286 16287
16287 16286  H     14.820194   19.740760  -11.374408     2 16285
16288 16287  H     15.746954   18.891734  -10.530509     2 16285
16289 16288  O    -12.012601   -2.386672  -34.160409     1 16289 16290
16290 16289  H    -12.546002   -1.621147  -34.374153     2 16288
16291 16290  H    -11.317313   -2.385976  -34.818289     2 16288
16292 16291  O      4.321817   16.629026  -19.451861     1 16292 16293
16293 16292  H      3.679213   15.944208  -19.637107     2 16291
16294 16293  H      4.551388   16.500108  -18.531585     2 16291
16295 16294  O      6.679325   19.728308   -5.444788     1 16295 16296
16296 16295  H      6.243395   19.276250   -6.167172     2 16294
16297 16296  H      7.470586   19.214595   -5.282811     2 16294
16298 16297  O      9.800124   16.523219   -0.671857     1 16298 16299
16299 16298  H      8.983966   16.697951   -0.203256     2 16297
16300 16299  H      9.931622   17.295987   -1.221192     2 16297
16301 16300  O     -0.486793    2.874806  -14.535447     1 16301 16302
16302 16301  H      0.442846    3.099564  -14.573990     2 16300
16303 16302  H     -0.651081    2.393233  -15.346206     2 16300
16304 16303  O      6.168640   21.276642  -26.895593     1 16304 16305
16305 16304  H      6.991769   20.831001  -26.695355     2 16303
16306 16305  H      5.550689   20.568759  -27.077993     2 16303
16307 16306  O     15.042803    6.671954   -9.320267     1 16307 16308
16308 16307  H     15.797670    6.111467   -9.140647     2 16306
16309 16308  H     14.294631    6.184769   -8.975128     2 16306
16310 16309  O     18.060365   22.189689   -9.952793     1 16310 16311
16311 16310  H     17.215967   21.767071  -10.109693     2 16309
16312 16311  H     17.898876   23.118150  -10.120466     2 16309
16313 16312  O    -27.060711   -9.122869   16.267827     1 16313 16314
16314 16313  H    -26.942762   -9.125223   15.317924     2 16312
16315 16314  H    -27.526511   -9.938137   16.453840     2 16312
16316 16315  O      9.559698   11.914496  -18.709883     1 16316 16317
16317 16316  H     10.181693   11.879651  -19.436615     2 16315
16318 16317  H      8.732204   11.616658  -19.087742     2 16315
16319 16318  O      6.910822   28.341848  -13.138904     1 16319 16320
16320 16319  H      7.791926   28.372084  -13.511695     2 16318
16321 16320  H      6.365097   27.988075  -13.841229     2 16318
16322 16321  O     36.062710   -0.095593   -3.483028     1 16322 16323
16323 16322  H     36.386455   -0.906749   -3.874752     2 16321
16324 16323  H     36.609830    0.031682   -2.707984     2 16321
16325 16324  O      1.310359    4.563630  -10.202302     1 16325 16326
16326 16325  H      1.293964    3.622293  -10.375065     2 16324
16327 16326  H      1.764227    4.645824   -9.363565     2 16324
16328 16327  O      1.188743   24.898794  -23.496313     1 16328 16329
16329 16328  H      0.423334   25.374912  -23.818326     2 16327
16330 16329  H      1.702957   25.558111  -23.030357     2 16327
16331 16330  O     -9.222399  -17.826437   26.891313     1 16331 16332
16332 16331  H     -9.785799  -17.546786   27.612844     2 16330
16333 16332  H     -9.394026  -17.193842   26.193747     2 16330
16334 16333  O    -25.077713  -10.259999   18.886864     1 16334 16335
16335 16334  H    -25.120968   -9.556738   18.238957     2 16333
16336 16335  H    -25.829561  -10.817496   18.686483     2 16333
16337 16336  O      3.842838   23.180579  -22.463642     1 16337 16338
16338 16337  H      3.104864   22.960828  -23.032268     2 16336
16339 16338  H      4.588756   23.259628  -23.058276     2 16336
16340 16339  O     14.092129    1.316070  -32.102298     1 16340 16341
16341 16340  H     13.788085    1.246730  -33.007274     2 16339
16342 16341  H     13.468684    1.910221  -31.684528     2 16339
16343 16342  O     26.810397    8.499138  -15.671699     1 16343 16344
16344 16343  H     26.176569    7.796654  -15.816647     2 16342
16345 16344  H     27.016529    8.447580  -14.738381     2 16342
16346 16345  O     -2.121660  -29.398015   18.896131     1 16346 16347
16347 16346  H     -1.261447  -29.743678   19.134424     2 16345
16348 16347  H     -2.089838  -29.311031   17.943423     2 16345
16349 16348  O      2.859989   30.502197  -12.619450     1 16349 16350
16350 16349  H      2.724416   29.886258  -13.339499     2 16348
16351 16350  H      2.795352   29.965729  -11.829351     2 16348
16352 16351  O      2.884940   22.603509   -1.480918     1 16352 16353
16353 16352  H      3.257034   23.467377   -1.303405     2 16351
16354 16353  H      3.566758   21.988397   -1.210747     2 16351
16355 16354  O     11.919170    5.533490  -23.916766     1 16355 16356
16356 16355  H     12.217032    4.697202  -23.558809     2 16354
16357 16356  H     11.159908    5.307729  -24.454153     2 16354
16358 16357  O     11.171946   14.898598    1.869064     1 16358 16359
16359 16358  H     10.424027   14.517361    1.409164     2 16357
16360 16359  H     11.422817   15.652652    1.335493     2 16357
16361 16360  O     33.938482   -9.201273    4.411003     1 16361 16362
16362 16361  H     34.228422   -9.452952    3.534177     2 16360
16363 16362  H     34.747022   -9.118702    4.916648     2 16360
16364 16363  O     -4.818193    8.211684  -28.558856     1 16364 16365
16365 16364  H     -5.698604    8.547595  -28.726998     2 16363
16366 16365  H     -4.698913    7.516533  -29.205979     2 16363
16367 16366  O      4.819941   12.888240  -31.088068     1 16367 16368
16368 16367  H      4.781764   13.813905  -30.847409     2 16366
16369 16368  H      4.229773   12.810623  -31.837674     2 16366
16370 16369  O      9.742007   18.752925  -18.292212     1 16370 16371
16371 16370  H      9.755112   18.615184  -17.345065     2 16369
16372 16371  H      9.284797   17.987166  -18.639782     2 16369
16373 16372  O     17.837948   26.040991   -2.667224     1 16373 16374
16374 16373  H     18.050263   25.223275   -3.117218     2 16372
16375 16374  H     18.382161   26.700220   -3.097897     2 16372
16376 16375  O    -13.480889  -10.991471   24.085699     1 16376 16377
16377 16376  H    -14.118733  -10.305093   23.890065     2 16375
16378 16377  H    -13.572412  -11.616243   23.366314     2 16375
16379 16378  O     -3.286779   21.701488  -24.392662     1 16379 16380
16380 16379  H     -3.383660   22.631949  -24.595364     2 16378
16381 16380  H     -3.859570   21.559132  -23.639086     2 16378
16382 16381  O     19.049224   11.637169  -10.701563     1 16382 16383
16383 16382  H     18.897633   12.102093   -9.878704     2 16381
16384 16383  H     20.001917   11.611519  -10.790729     2 16381
16385 16384  O      5.768514   27.952286   -7.206365     1 16385 16386
16386 16385  H      6.671815   27.720532   -7.422164     2 16384
16387 16386  H      5.283818   27.811655   -8.019706     2 16384
16388 16387  O     -1.294121   27.242642   -4.794321     1 16388 16389
16389 16388  H     -1.398940   26.293568   -4.861441     2 16387
16390 16389  H     -2.154005   27.595797   -5.022599     2 16387
16391 16390  O      1.136551   20.294521   -2.625292     1 16391 16392
16392 16391  H      1.711076   21.009793   -2.898309     2 16390
16393 16392  H      0.251466   20.628977   -2.770188     2 16390
16394 16393  O      8.806488   22.515345   -5.642722     1 16394 16395
16395 16394  H      9.653708   22.092152   -5.503590     2 16393
16396 16395  H      8.292968   22.284624   -4.868579     2 16393
16397 16396  O     28.770051    0.308840  -10.979842     1 16397 16398
16398 16397  H     27.957218    0.691756  -10.649829     2 16396
16399 16398  H     29.178214    1.011424  -11.485816     2 16396
16400 16399  O      9.579477   11.582933  -24.266513     1 16400 16401
16401 16400  H     10.376033   11.523622  -24.793971     2 16399
16402 16401  H      9.359548   10.674302  -24.060957     2 16399
16403 16402  O      2.286930   19.663867   -5.796958     1 16403 16404
16404 16403  H      1.437113   19.611875   -5.359533     2 16402
16405 16404  H      2.587646   20.557446   -5.631678     2 16402
16406 16405  O     14.886676    9.687320  -12.490206     1 16406 16407
16407 16406  H     15.142041    9.737668  -11.569073     2 16405
16408 16407  H     14.013852   10.079214  -12.519037     2 16405
16409 16408  O     -0.074741   19.271762  -17.442562     1 16409 16410
16410 16409  H     -0.556771   20.097741  -17.483037     2 16408
16411 16410  H      0.760677   19.460237  -17.870096     2 16408
16412 16411  O     15.327589   14.834281   -8.472601     1 16412 16413
16413 16412  H     15.467541   14.624665   -9.396022     2 16411
16414 16413  H     15.828368   14.171215   -7.997423     2 16411
16415 16414  O      1.308717    7.926956  -21.651233     1 16415 16416
16416 16415  H      0.525505    8.442377  -21.843979     2 16414
16417 16416  H      1.655062    8.309109  -20.844861     2 16414
16418 16417  O     11.749023   26.316916    0.258258     1 16418 16419
16419 16418  H     11.459640   25.624213    0.852102     2 16417
16420 16419  H     12.161938   26.965156    0.828799     2 16417
16421 16420  O     15.728006    6.989371  -21.139328     1 16421 16422
16422 16421  H     14.986493    7.582301  -21.017578     2 16420
16423 16422  H     16.444838    7.556684  -21.423124     2 16420
16424 16423  O    -12.151961  -11.775352   21.399208     1 16424 16425
16425 16424  H    -11.356318  -11.760270   21.931144     2 16423
16426 16425  H    -12.368345  -12.704174   21.317349     2 16423
16427 16426  O     -6.901579    3.144783   35.411629     1 16427 16428
16428 16427  H     -6.405711    2.863283   36.180462     2 16426
16429 16428  H     -6.646155    4.058198   35.282543     2 16426
16430 16429  O      5.696561   34.563036   -0.798709     1 16430 16431
16431 16430  H      6.530652   34.939271   -1.079728     2 16429
16432 16431  H      5.924291   33.693615   -0.469348     2 16429
16433 16432  O     17.657145   15.846122   -6.195490     1 16433 16434
16434 16433  H     16.942081   16.059012   -5.595830     2 16432
16435 16434  H     17.548503   14.912527   -6.376676     2 16432
16436 16435  O    -27.298935   -7.590906   18.530201     1 16436 16437
16437 16436  H    -27.389789   -8.316027   17.911996     2 16435
16438 16437  H    -27.134844   -6.825281   17.979635     2 16435
16439 16438  O      1.780768   22.819693  -15.416057     1 16439 16440
16440 16439  H      1.463911   22.477585  -14.580117     2 16438
16441 16440  H      1.231849   23.585315  -15.585590     2 16438
16442 16441  O      8.429349    2.823476   -2.856309     1 16442 16443
16443 16442  H      9.270805    2.424116   -2.635638     2 16441
16444 16443  H      8.488611    3.714295   -2.511111     2 16441
16445 16444  O    -33.618946   -8.749156   11.160563     1 16445 16446
16446 16445  H    -32.675736   -8.738125   10.997881     2 16444
16447 16446  H    -33.917598   -9.577361   10.784910     2 16444
16448 16447  O    -22.441342  -10.157238   20.520360     1 16448 16449
16449 16448  H    -22.133425   -9.540489   19.856252     2 16447
16450 16449  H    -22.973261  -10.787420   20.034392     2 16447
16451 16450  O     11.218307   12.510535   -8.750597     1 16451 16452
16452 16451  H     10.886179   12.119888   -9.558878     2 16450
16453 16452  H     10.433487   12.708856   -8.239756     2 16450
16454 16453  O      2.840764  -34.643170   -1.622035     1 16454 16455
16455 16454  H      2.888278  -34.634846   -0.666051     2 16453
16456 16455  H      1.925353  -34.444098   -1.818564     2 16453
16457 16456  O      3.995225    3.001431   -4.512513     1 16457 16458
16458 16457  H      3.445132    2.804218   -3.754400     2 16456
16459 16458  H      4.117788    2.156994   -4.946261     2 16456
16460 16459  O     12.123748   34.154389   -5.940971     1 16460 16461
16461 16460  H     11.565640   34.753471   -5.445140     2 16459
16462 16461  H     11.524583   33.483261   -6.267804     2 16459
16463 16462  O     -0.916369    9.347396  -13.961192     1 16463 16464
16464 16463  H     -1.343293    9.723384  -14.730998     2 16462
16465 16464  H     -1.345999    9.770562  -13.217835     2 16462
16466 16465  O      6.569095   21.180777  -13.515754     1 16466 16467
16467 16466  H      6.630997   20.836428  -14.406722     2 16465
16468 16467  H      5.959628   20.590791  -13.072248     2 16465
16469 16468  O      0.355373   20.777544  -11.233817     1 16469 16470
16470 16469  H      0.567422   21.182498  -10.392818     2 16468
16471 16470  H     -0.412012   20.234980  -11.052222     2 16468
16472 16471  O      1.478813    5.493573  -34.694198     1 16472 16473
16473 16472  H      1.384945    6.272382  -35.242721     2 16471
16474 16473  H      2.421657    5.414299  -34.549311     2 16471
16475 16474  O     17.061161   25.833223   -7.365563     1 16475 16476
16476 16475  H     16.262986   25.366869   -7.613881     2 16474
16477 16476  H     17.756591   25.181072   -7.451043     2 16474
16478 16477  O     10.567307    0.944741  -17.838689     1 16478 16479
16479 16478  H     10.838988    0.648960  -16.969819     2 16477
16480 16479  H     10.258152    0.151608  -18.276405     2 16477
16481 16480  O     12.739241    3.076563  -23.038434     1 16481 16482
16482 16481  H     13.631323    3.357091  -23.242704     2 16480
16483 16482  H     12.790933    2.121546  -22.999663     2 16480
16484 16483  O     18.642913   23.290213   -7.063673     1 16484 16485
16485 16484  H     18.105931   22.750232   -7.643588     2 16483
16486 16485  H     18.940695   22.687611   -6.382183     2 16483
16487 16486  O     23.185318    9.005203   -2.987818     1 16487 16488
16488 16487  H     22.575805    8.798525   -2.279292     2 16486
16489 16488  H     23.538613    8.156841   -3.255579     2 16486
16490 16489  O     -7.964357  -15.262599   21.502116     1 16490 16491
16491 16490  H     -8.603415  -15.779092   21.011127     2 16489
16492 16491  H     -7.115350  -15.616526   21.237248     2 16489
16493 16492  O      7.312551   16.356504   -4.241162     1 16493 16494
16494 16493  H      7.339947   16.816720   -3.402305     2 16492
16495 16494  H      7.044569   15.465267   -4.017302     2 16492
16496 16495  O     10.747916   24.084554   -7.604474     1 16496 16497
16497 16496  H     10.770312   23.494541   -6.851071     2 16495
16498 16497  H      9.885663   23.942426   -7.995052     2 16495
16499 16498  O     16.144587    4.327817  -15.649250     1 16499 16500
16500 16499  H     15.933392    4.908617  -14.918293     2 16498
16501 16500  H     16.305068    4.917669  -16.385832     2 16498
16502 16501  O     20.747789   -2.175066  -16.621416     1 16502 16503
16503 16502  H     19.875572   -2.336551  -16.981125     2 16501
16504 16503  H     21.343333   -2.341844  -17.351995     2 16501
16505 16504  O      9.563235   12.557549  -11.267019     1 16505 16506
16506 16505  H      9.557516   13.509199  -11.164251     2 16504
16507 16506  H      8.770505   12.262978  -10.818645     2 16504
16508 16507  O      1.663826   22.079445  -24.041443     1 16508 16509
16509 16508  H      1.303853   22.965569  -24.079334     2 16507
16510 16509  H      0.899571   21.506919  -24.107472     2 16507
16511 16510  O     10.778315   25.860242   -5.035485     1 16511 16512
16512 16511  H     10.982842   25.022843   -5.451614     2 16510
16513 16512  H     10.556483   26.441763   -5.762709     2 16510
16514 16513  O      9.421788   -1.625119  -26.395020     1 16514 16515
16515 16514  H      9.250678   -0.687018  -26.478209     2 16513
16516 16515  H     10.207924   -1.678405  -25.851529     2 16513
16517 16516  O     20.754225   -6.009122  -12.155906     1 16517 16518
16518 16517  H     20.027654   -5.397839  -12.276979     2 16516
16519 16518  H     21.244626   -5.964599  -12.976733     2 16516
16520 16519  O    -22.335278   -0.226700   31.077324     1 16520 16521
16521 16520  H    -22.868526   -0.917711   30.684408     2 16519
16522 16521  H    -22.423835   -0.362348   32.020716     2 16519
16523 16522  O     -0.411054   29.137112   -8.853468     1 16523 16524
16524 16523  H      0.217083   28.442368   -8.655972     2 16522
16525 16524  H     -1.197211   28.896295   -8.363369     2 16522
16526 16525  O      7.993316   12.091368  -30.153945     1 16526 16527
16527 16526  H      8.007689   12.072544  -31.110851     2 16525
16528 16527  H      8.116234   13.013895  -29.930185     2 16525
16529 16528  O      9.526705   30.325883  -12.795059     1 16529 16530
16530 16529  H      9.956964   29.497207  -12.584337     2 16528
16531 16530  H      9.413502   30.302691  -13.745258     2 16528
16532 16531  O      7.703714    7.538573    0.757418     1 16532 16533
16533 16532  H      7.887951    7.984807    1.583956     2 16531
16534 16533  H      7.682426    8.239452    0.105845     2 16531
16535 16534  O     11.598907   22.667998  -19.814802     1 16535 16536
16536 16535  H     11.426037   23.067455  -20.667317     2 16534
16537 16536  H     10.741373   22.624749  -19.391722     2 16534
16538 16537  O     -4.546977    1.916977  -13.844356     1 16538 16539
16539 16538  H     -3.682530    2.060490  -13.459170     2 16537
16540 16539  H     -4.609316    2.567925  -14.543363     2 16537
16541 16540  O      6.323705   14.800864  -20.050442     1 16541 16542
16542 16541  H      5.533012   15.287936  -19.818500     2 16540
16543 16542  H      6.352501   14.831363  -21.006723     2 16540
16544 16543  O     17.795114    5.519593   -0.109521     1 16544 16545
16545 16544  H     17.246796    4.746450   -0.243042     2 16543
16546 16545  H     18.211256    5.374828    0.740245     2 16543
16547 16546  O     17.438340   27.626269    7.198565     1 16547 16548
16548 16547  H     16.723469   28.222400    7.421766     2 16546
16549 16548  H     17.101966   26.756595    7.414784     2 16546
16550 16549  O    -23.660993  -11.056722   15.354874     1 16550 16551
16551 16550  H    -24.146978  -11.439463   14.624423     2 16549
16552 16551  H    -24.036065  -10.182462   15.460808     2 16549
16553 16552  O    -35.118790   -0.591283   16.870953     1 16553 16554
16554 16553  H    -35.846424   -0.289537   17.414764     2 16552
16555 16554  H    -35.297179   -1.520377   16.725375     2 16552
16556 16555  O      9.914281   22.830609  -15.128345     1 16556 16557
16557 16556  H      9.429054   23.133110  -14.360700     2 16555
16558 16557  H      9.962336   21.880460  -15.022797     2 16555
16559 16558  O      2.408099   24.937525  -12.030904     1 16559 16560
16560 16559  H      2.789063   25.109908  -12.891939     2 16558
16561 16560  H      1.751164   24.259871  -12.190442     2 16558
16562 16561  O      4.732710   10.190790  -10.960956     1 16562 16563
16563 16562  H      4.797613   10.827349  -11.672864     2 16561
16564 16563  H      3.824012    9.891264  -10.988948     2 16561
16565 16564  O     -1.327386   24.317961    3.276181     1 16565 16566
16566 16565  H     -1.765020   24.159402    4.112583     2 16564
16567 16566  H     -0.822161   23.521128    3.114826     2 16564
16568 16567  O      1.080851    0.874756  -23.055404     1 16568 16569
16569 16568  H      1.273934    1.753031  -23.383407     2 16567
16570 16569  H      1.355170    0.895293  -22.138585     2 16567
16571 16570  O      5.917160   21.177782  -20.417586     1 16571 16572
16572 16571  H      5.638366   20.277009  -20.582249     2 16570
16573 16572  H      5.107864   21.645662  -20.211774     2 16570
16574 16573  O    -35.796532    6.321897   -3.445952     1 16574 16575
16575 16574  H    -35.044332    6.355417   -4.036972     2 16573
16576 16575  H    -35.873421    5.398060   -3.207530     2 16573
16577 16576  O    -25.835239   -1.742579   25.963632     1 16577 16578
16578 16577  H    -26.126364   -1.640678   26.869775     2 16576
16579 16578  H    -26.266389   -1.030239   25.491496     2 16576
16580 16579  O    -29.079512   -3.206751   18.665300     1 16580 16581
16581 16580  H    -29.606645   -2.978935   17.899492     2 16579
16582 16581  H    -28.292686   -3.613681   18.302610     2 16579
16583 16582  O     12.942729   10.025147   -8.258744     1 16583 16584
16584 16583  H     12.714261    9.926934   -9.183075     2 16582
16585 16584  H     12.503161   10.830919   -7.987190     2 16582
16586 16585  O      3.977034   17.859574  -16.709241     1 16586 16587
16587 16586  H      4.922109   17.954380  -16.590594     2 16585
16588 16587  H      3.619139   17.894062  -15.822137     2 16585
16589 16588  O     14.956953   -1.740035  -15.681877     1 16589 16590
16590 16589  H     14.678910   -1.404272  -14.829711     2 16588
16591 16590  H     14.182995   -1.652869  -16.238315     2 16588
16592 16591  O     14.775226   35.041497    1.167742     1 16592 16593
16593 16592  H     14.384987   34.205182    0.913729     2 16591
16594 16593  H     15.684778   34.828390    1.376384     2 16591
16595 16594  O     10.291324   25.672953   -2.401911     1 16595 16596
16596 16595  H     10.639206   25.658295   -3.293536     2 16594
16597 16596  H     10.879744   26.257663   -1.924304     2 16594
16598 16597  O      3.063233   21.990476   -4.986216     1 16598 16599
16599 16598  H      3.503575   22.060377   -5.833236     2 16597
16600 16599  H      3.324276   22.781140   -4.514052     2 16597
16601 16600  O     -1.500682    8.575842  -18.507047     1 16601 16602
16602 16601  H     -1.995077    9.068294  -19.162254     2 16600
16603 16602  H     -2.169761    8.189199  -17.942184     2 16600
16604 16603  O      2.024060    9.302673  -31.989477     1 16604 16605
16605 16604  H      2.909638    9.245372  -31.630730     2 16603
16606 16605  H      1.813039    8.406693  -32.252006     2 16603
16607 16606  O      9.267514   18.887435   -5.758382     1 16607 16608
16608 16607  H     10.016357   19.125331   -5.211690     2 16606
16609 16608  H      9.620438   18.854159   -6.647521     2 16606
16610 16609  O     16.117584   10.796875   -3.379753     1 16610 16611
16611 16610  H     15.428260   11.459109   -3.329650     2 16609
16612 16611  H     16.676728   11.086553   -4.100639     2 16609
16613 16612  O     14.271051   25.166361   -0.790908     1 16613 16614
16614 16613  H     14.598192   25.663191   -1.540822     2 16612
16615 16614  H     13.432864   25.576814   -0.578303     2 16612
16616 16615  O     20.073694    4.629616   -6.513534     1 16616 16617
16617 16616  H     19.844835    4.025551   -5.807162     2 16615
16618 16617  H     20.255011    5.458754   -6.070945     2 16615
16619 16618  O     12.486864   29.705138   -8.813850     1 16619 16620
16620 16619  H     13.181434   29.701203   -8.155223     2 16618
16621 16620  H     12.652039   30.492762   -9.332114     2 16618
16622 16621  O     28.408350   12.223358  -10.391782     1 16622 16623
16623 16622  H     28.876647   11.444687  -10.090783     2 16621
16624 16623  H     29.075077   12.748013  -10.835000     2 16621
16625 16624  O     11.615345   19.463674   -4.189047     1 16625 16626
16626 16625  H     12.477893   19.050428   -4.150727     2 16624
16627 16626  H     11.799763   20.390173   -4.343393     2 16624
16628 16627  O     -1.151719   11.517489   -1.463016     1 16628 16629
16629 16628  H     -0.973982   10.706310   -0.986960     2 16627
16630 16629  H     -1.173646   11.255692   -2.383458     2 16627
16631 16630  O     10.422859   18.077237  -15.704322     1 16631 16632
16632 16631  H      9.700588   18.046292  -15.076948     2 16630
16633 16632  H     11.042748   17.419429  -15.389269     2 16630
16634 16633  O      0.591256    5.643523  -16.105702     1 16634 16635
16635 16634  H      0.369226    5.987852  -15.240617     2 16633
16636 16635  H     -0.225538    5.264020  -16.429826     2 16633
16637 16636  O     18.023028    5.548749   -8.209047     1 16637 16638
16638 16637  H     18.477296    5.593194   -9.050413     2 16636
16639 16638  H     18.715234    5.373648   -7.571535     2 16636
16640 16639  O     29.556591    6.958617   -8.635756     1 16640 16641
16641 16640  H     28.738953    6.542157   -8.363247     2 16639
16642 16641  H     29.832013    7.468135   -7.873676     2 16639
16643 16642  O      0.248576   35.373097   -6.923866     1 16643 16644
16644 16643  H      0.533258   36.280594   -6.815991     2 16642
16645 16644  H      1.015834   34.920991   -7.274790     2 16642
16646 16645  O      5.469340   18.249692   -7.428836     1 16646 16647
16647 16646  H      5.352734   17.348056   -7.129358     2 16645
16648 16647  H      4.616483   18.495792   -7.787027     2 16645
16649 16648  O     13.640834    6.328330   -4.520732     1 16649 16650
16650 16649  H     13.382871    5.435635   -4.750480     2 16648
16651 16650  H     13.721605    6.778699   -5.361491     2 16648
16652 16651  O      9.851096   21.206302  -10.261605     1 16652 16653
16653 16652  H     10.364767   21.701485   -9.623509     2 16651
16654 16653  H      9.629748   20.391333   -9.810979     2 16651
16655 16654  O     21.780234   18.239772  -14.291022     1 16655 16656
16656 16655  H     21.006123   18.322778  -13.734162     2 16654
16657 16656  H     22.444270   17.850034  -13.722346     2 16654
16658 16657  O     19.628622   15.536947    0.343075     1 16658 16659
16659 16658  H     20.550708   15.645400    0.110207     2 16657
16660 16659  H     19.600469   14.717028    0.836200     2 16657
16661 16660  O      0.998672  -31.555379   -6.681293     1 16661 16662
16662 16661  H      0.967523  -30.610051   -6.828316     2 16660
16663 16662  H      0.146447  -31.767225   -6.300417     2 16660
16664 16663  O      1.637270  -27.204411   24.395583     1 16664 16665
16665 16664  H      1.636026  -27.019247   25.334702     2 16663
16666 16665  H      0.735040  -27.045140   24.118377     2 16663
16667 16666  O     23.495111   -1.486944  -22.852787     1 16667 16668
16668 16667  H     24.418876   -1.366165  -23.072563     2 16666
16669 16668  H     23.186922   -2.151972  -23.468408     2 16666
16670 16669  O      7.567748   16.950896    0.834205     1 16670 16671
16671 16670  H      6.671299   17.215384    0.627671     2 16669
16672 16671  H      7.513805   16.590801    1.719447     2 16669
16673 16672  O    -23.691670   -4.000199   26.884316     1 16673 16674
16674 16673  H    -24.117813   -3.548329   26.155998     2 16672
16675 16674  H    -22.949633   -3.440398   27.112868     2 16672
16676 16675  O      1.929782   13.838782   -5.686612     1 16676 16677
16677 16676  H      2.283104   12.952132   -5.614170     2 16675
16678 16677  H      2.192911   14.269183   -4.873133     2 16675
16679 16678  O     12.617316   15.170259   -8.991214     1 16679 16680
16680 16679  H     13.393779   14.956958   -8.473682     2 16678
16681 16680  H     12.216976   14.322416   -9.183884     2 16678
16682 16681  O     24.236312    6.611747   -7.005002     1 16682 16683
16683 16682  H     24.022827    6.810884   -7.916593     2 16681
16684 16683  H     24.197024    5.656800   -6.952415     2 16681
16685 16684  O     18.437116   19.059527   -3.934850     1 16685 16686
16686 16685  H     18.499091   19.597342   -3.145454     2 16684
16687 16686  H     18.717274   18.188306   -3.654284     2 16684
16688 16687  O     31.029084    4.459236   -8.477148     1 16688 16689
16689 16688  H     30.648961    4.946991   -7.746510     2 16687
16690 16689  H     30.684959    3.571554   -8.377994     2 16687
16691 16690  O     15.554840    9.123408  -23.540352     1 16691 16692
16692 16691  H     14.673065    8.752357  -23.508325     2 16690
16693 16692  H     15.596865    9.707958  -22.783538     2 16690
16694 16693  O      2.098831   -4.183630  -32.935737     1 16694 16695
16695 16694  H      1.807373   -4.112222  -32.026789     2 16693
16696 16695  H      2.485527   -3.330185  -33.131516     2 16693
16697 16696  O      9.231192   19.038085   -8.904906     1 16697 16698
16698 16697  H      9.340933   18.162608   -9.276023     2 16696
16699 16698  H      8.325023   19.272041   -9.105791     2 16696
16700 16699  O      2.235133    5.527163   -3.603105     1 16700 16701
16701 16700  H      2.158991    6.408999   -3.238691     2 16699
16702 16701  H      2.805804    5.630621   -4.364592     2 16699
16703 16702  O      1.061558    9.080735  -19.087988     1 16703 16704
16704 16703  H      0.160873    8.771346  -18.991672     2 16702
16705 16704  H      1.547362    8.622420  -18.402296     2 16702
16706 16705  O      5.171834    9.664171  -17.151558     1 16706 16707
16707 16706  H      4.512938    9.312081  -16.553127     2 16705
16708 16707  H      5.962021    9.745564  -16.617507     2 16705
16709 16708  O      4.494814   31.583913   -9.331964     1 16709 16710
16710 16709  H      3.734892   31.139631   -8.955978     2 16708
16711 16710  H      4.852323   30.957171   -9.960942     2 16708
16712 16711  O     12.175175   14.390091  -12.390603     1 16712 16713
16713 16712  H     11.557119   14.966381  -11.941016     2 16711
16714 16713  H     12.702409   14.978506  -12.930996     2 16711
16715 16714  O     12.870470   -3.213867    1.069985     1 16715 16716
16716 16715  H     12.299905   -3.511792    1.778454     2 16714
16717 16716  H     12.685881   -2.277992    0.990637     2 16714
16718 16717  O     19.563664   21.516899   -5.147624     1 16718 16719
16719 16718  H     20.419292   21.344579   -4.754637     2 16717
16720 16719  H     19.082734   20.695656   -5.045166     2 16717
16721 16720  O      7.598259    9.065590  -11.365965     1 16721 16722
16722 16721  H      7.025511    9.726816  -10.977413     2 16720
16723 16722  H      7.003084    8.470747  -11.822210     2 16720
16724 16723  O     12.772911   13.540088  -26.548113     1 16724 16725
16725 16724  H     12.603140   13.501453  -27.489344     2 16723
16726 16725  H     13.716458   13.686182  -26.480239     2 16723
16727 16726  O     14.967044   10.475838  -18.280865     1 16727 16728
16728 16727  H     14.441705   10.042437  -17.608248     2 16726
16729 16728  H     15.812423   10.633529  -17.860509     2 16726
16730 16729  O    -13.109249  -12.625067   27.179524     1 16730 16731
16731 16730  H    -12.616485  -12.590601   26.359629     2 16729
16732 16731  H    -14.027116  -12.627359   26.907958     2 16729
16733 16732  O     18.710124    6.537908  -10.789585     1 16733 16734
16734 16733  H     18.199181    6.161144  -11.505977     2 16732
16735 16734  H     18.912367    7.427030  -11.080777     2 16732
16736 16735  O     28.529639   12.551516   -5.814609     1 16736 16737
16737 16736  H     29.121279   11.841412   -5.565720     2 16735
16738 16737  H     29.018310   13.053561   -6.466823     2 16735
16739 16738  O     19.908605    7.704948  -16.326019     1 16739 16740
16740 16739  H     20.590225    7.681491  -16.997641     2 16738
16741 16740  H     19.092997    7.811952  -16.815474     2 16738
16742 16741  O     -2.038843   25.726430   -8.018424     1 16742 16743
16743 16742  H     -2.309292   25.021230   -8.606456     2 16741
16744 16743  H     -1.133916   25.913398   -8.268191     2 16741
16745 16744  O     31.516142   11.099045   -6.884252     1 16745 16746
16746 16745  H     31.973593   11.937703   -6.824073     2 16744
16747 16746  H     31.565856   10.734606   -6.000541     2 16744
16748 16747  O     -1.132354   22.253934  -17.350766     1 16748 16749
16749 16748  H     -0.262687   22.553649  -17.615496     2 16747
16750 16749  H     -1.247943   22.603354  -16.467151     2 16747
16751 16750  O     33.761749    8.107795   -7.453302     1 16751 16752
16752 16751  H     33.554806    7.201438   -7.225439     2 16750
16753 16752  H     34.506646    8.331446   -6.895323     2 16750
16754 16753  O     21.522036    9.857181  -15.508150     1 16754 16755
16755 16754  H     22.425223    9.786362  -15.817132     2 16753
16756 16755  H     21.100052    9.054373  -15.814190     2 16753
16757 16756  O     13.094755   28.546615   -4.580494     1 16757 16758
16758 16757  H     12.252832   28.997731   -4.642889     2 16756
16759 16758  H     12.940577   27.693521   -4.986316     2 16756
16760 16759  O     22.764106    6.109182  -13.392037     1 16760 16761
16761 16760  H     22.810556    7.060286  -13.294699     2 16759
16762 16761  H     22.408657    5.799750  -12.558887     2 16759
16763 16762  O      6.928999   31.232268   -4.500272     1 16763 16764
16764 16763  H      6.823448   31.247107   -5.451519     2 16762
16765 16764  H      7.671490   31.812495   -4.332119     2 16762
16766 16765  O      3.545517   16.304855  -12.628245     1 16766 16767
16767 16766  H      2.751187   15.889157  -12.292885     2 16765
16768 16767  H      3.237200   16.885000  -13.324380     2 16765
16769 16768  O      2.352406   19.536383  -18.593837     1 16769 16770
16770 16769  H      3.082769   19.283424  -18.029201     2 16768
16771 16770  H      2.767129   19.836855  -19.402511     2 16768
16772 16771  O      4.412938   29.444838   -2.432507     1 16772 16773
16773 16772  H      4.308772   30.394998   -2.381753     2 16771
16774 16773  H      4.605363   29.273410   -3.354362     2 16771
16775 16774  O     25.506682   11.024572   -3.539694     1 16775 16776
16776 16775  H     24.925964   11.759555   -3.736666     2 16774
16777 16776  H     25.063647   10.262172   -3.912117     2 16774
16778 16777  O      6.667197    3.278592  -11.024480     1 16778 16779
16779 16778  H      7.036368    4.097721  -10.694369     2 16777
16780 16779  H      6.634462    3.395543  -11.973945     2 16777
16781 16780  O      9.607203   14.614977   -4.579994     1 16781 16782
16782 16781  H      8.901239   15.253713   -4.480681     2 16780
16783 16782  H      9.655666   14.176796   -3.730358     2 16780
16784 16783  O      7.635086   25.283729  -19.105441     1 16784 16785
16785 16784  H      7.184521   25.669545  -18.354196     2 16783
16786 16785  H      8.256536   24.665483  -18.720990     2 16783
16787 16786  O      6.600548   31.590062   -7.315394     1 16787 16788
16788 16787  H      6.195112   32.456797   -7.290426     2 16786
16789 16788  H      5.954469   31.035402   -7.752618     2 16786
16790 16789  O     11.824459    9.997690   -5.452222     1 16790 16791
16791 16790  H     12.005427   10.879285   -5.778215     2 16789
16792 16791  H     12.654170    9.530565   -5.550227     2 16789
16793 16792  O     -0.922367    6.792449    0.899668     1 16793 16794
16794 16793  H     -0.287641    6.077763    0.848874     2 16792
16795 16794  H     -1.540292    6.615490    0.190383     2 16792
16796 16795  O      0.262973   30.556903   13.050391     1 16796 16797
16797 16796  H      1.008616   30.348948   12.487360     2 16795
16798 16797  H     -0.106604   31.355609   12.673945     2 16795
16799 16798  O     25.350221   -0.408272    4.262430     1 16799 16800
16800 16799  H     24.976564    0.123344    4.965279     2 16798
16801 16800  H     25.402371    0.185977    3.513845     2 16798
16802 16801  O     14.540311    5.428621    7.727490     1 16802 16803
16803 16802  H     14.180850    6.011342    8.396411     2 16801
16804 16803  H     15.405127    5.790273    7.533758     2 16801
16805 16804  O     10.220422   11.656836   25.852738     1 16805 16806
16806 16805  H     10.661180   11.983564   26.637093     2 16804
16807 16806  H      9.870451   12.441015   25.429872     2 16804
16808 16807  O      1.794912  -35.753060   -4.630269     1 16808 16809
16809 16808  H      1.915813  -34.949798   -4.123925     2 16807
16810 16809  H      2.596165  -35.833454   -5.147727     2 16807
16811 16810  O    -16.186480  -20.244549  -13.943753     1 16811 16812
16812 16811  H    -16.037834  -21.186607  -14.025371     2 16810
16813 16812  H    -17.137243  -20.156562  -13.876363     2 16810
16814 16813  O     12.237072   14.318541   11.710597     1 16814 16815
16815 16814  H     12.171693   14.120194   10.776458     2 16813
16816 16815  H     13.174914   14.428281   11.867569     2 16813
16817 16816  O     15.275496   11.150419    9.900914     1 16817 16818
16818 16817  H     14.325807   11.268020    9.923091     2 16816
16819 16818  H     15.605859   11.736518   10.581781     2 16816
16820 16819  O     25.475094    8.942636    7.030170     1 16820 16821
16821 16820  H     25.967434    8.145225    7.225025     2 16819
16822 16821  H     25.350758    9.361997    7.881585     2 16819
16823 16822  O     18.099319   12.358636    0.493397     1 16823 16824
16824 16823  H     18.248228   12.175519    1.421042     2 16822
16825 16824  H     17.514616   11.659219    0.201558     2 16822
16826 16825  O     16.089882    4.093273   19.178033     1 16826 16827
16827 16826  H     15.333368    3.806948   18.666237     2 16825
16828 16827  H     16.578232    4.664659   18.585357     2 16825
16829 16828  O     28.403372   15.456950    8.056964     1 16829 16830
16830 16829  H     28.460221   15.201482    8.977689     2 16828
16831 16830  H     28.727606   14.695422    7.576153     2 16828
16832 16831  O      5.027112    0.692524   18.894064     1 16832 16833
16833 16832  H      5.364901    0.986914   19.739916     2 16831
16834 16833  H      4.131212    0.410397   19.078452     2 16831
16835 16834  O     17.218955   16.406525   -1.114793     1 16835 16836
16836 16835  H     16.644470   16.229865   -1.859769     2 16834
16837 16836  H     17.127573   15.636639   -0.553404     2 16834
16838 16837  O     23.593674    6.639673   10.882672     1 16838 16839
16839 16838  H     24.057212    6.017225   11.442961     2 16837
16840 16839  H     23.579823    6.222874   10.021094     2 16837
16841 16840  O      0.437125    3.034618   25.265690     1 16841 16842
16842 16841  H      0.055798    3.905213   25.379209     2 16840
16843 16842  H      1.258766    3.066749   25.755694     2 16840
16844 16843  O      6.136159    7.627369   29.923041     1 16844 16845
16845 16844  H      6.403257    6.825172   29.474299     2 16843
16846 16845  H      6.487271    8.333856   29.380981     2 16843
16847 16846  O      7.515753   29.007945    3.215376     1 16847 16848
16848 16847  H      7.359902   29.913717    2.947947     2 16846
16849 16848  H      7.493613   29.032962    4.171993     2 16846
16850 16849  O    -11.980929  -26.656614  -11.948115     1 16850 16851
16851 16850  H    -11.057893  -26.909859  -11.937919     2 16849
16852 16851  H    -11.991573  -25.773464  -11.579110     2 16849
16853 16852  O      7.900077    6.810285   34.190410     1 16853 16854
16854 16853  H      6.969891    7.009920   34.295912     2 16852
16855 16854  H      8.171916    6.474767   35.044672     2 16852
16856 16855  O     22.306233   10.858437    5.369692     1 16856 16857
16857 16856  H     21.775547   11.484148    5.862733     2 16855
16858 16857  H     23.043808   11.373960    5.043424     2 16855
16859 16858  O    -28.977490  -14.339850   -7.061983     1 16859 16860
16860 16859  H    -28.694010  -15.202866   -7.363769     2 16858
16861 16860  H    -29.728047  -14.126359   -7.616345     2 16858
16862 16861  O      0.735905    7.734529   30.171440     1 16862 16863
16863 16862  H      1.629420    7.746460   29.828338     2 16861
16864 16863  H      0.196387    7.468965   29.426706     2 16861
16865 16864  O     17.277391    6.291097    7.879886     1 16865 16866
16866 16865  H     17.209218    6.919240    7.160844     2 16864
16867 16866  H     17.481862    6.825769    8.647055     2 16864
16868 16867  O      0.977213    2.346547   11.445820     1 16868 16869
16869 16868  H      0.882465    2.911352   12.212795     2 16867
16870 16869  H      0.319565    1.662058   11.569130     2 16867
16871 16870  O      3.461089   15.555164   30.256635     1 16871 16872
16872 16871  H      3.064297   14.994452   29.590009     2 16870
16873 16872  H      4.244616   15.909864   29.836509     2 16870
16874 16873  O      5.399818   17.820923    6.586988     1 16874 16875
16875 16874  H      5.106380   18.586874    6.093587     2 16873
16876 16875  H      4.687142   17.188604    6.494807     2 16873
16877 16876  O     12.001744    5.813368    6.429313     1 16877 16878
16878 16877  H     11.924560    6.718123    6.126506     2 16876
16879 16878  H     12.625125    5.855351    7.154479     2 16876
16880 16879  O      5.914871   12.677964   17.358093     1 16880 16881
16881 16880  H      5.294085   13.203342   16.853280     2 16879
16882 16881  H      6.395347   12.175936   16.699806     2 16879
16883 16882  O     23.055940   20.014131   -0.489131     1 16883 16884
16884 16883  H     22.211111   20.256814   -0.110184     2 16882
16885 16884  H     23.479302   19.485340    0.187165     2 16882
16886 16885  O     -7.961744  -33.609516  -12.739268     1 16886 16887
16887 16886  H     -8.459435  -32.933470  -13.199155     2 16885
16888 16887  H     -7.214644  -33.143751  -12.363589     2 16885
16889 16888  O     10.355561    6.578389   10.071394     1 16889 16890
16890 16889  H      9.966688    6.380231   10.923300     2 16888
16891 16890  H     10.194946    7.513646    9.945975     2 16888
16892 16891  O      5.946820   35.705451    7.438563     1 16892 16893
16893 16892  H      6.336453   36.528106    7.142496     2 16891
16894 16893  H      6.090335   35.698828    8.384920     2 16891
16895 16894  O      8.766549   26.906962   15.020413     1 16895 16896
16896 16895  H      8.775630   26.089024   14.523296     2 16894
16897 16896  H      8.180635   26.733510   15.757197     2 16894
16898 16897  O      9.301848   13.478305    0.834225     1 16898 16899
16899 16898  H      9.575343   12.691794    0.362174     2 16897
16900 16899  H      8.383129   13.320429    1.051621     2 16897
16901 16900  O      6.430927   16.924072   15.240986     1 16901 16902
16902 16901  H      7.286385   16.521814   15.090613     2 16900
16903 16902  H      5.908084   16.231939   15.645728     2 16900
16904 16903  O     11.884170   17.425310    6.665798     1 16904 16905
16905 16904  H     12.822340   17.447744    6.854391     2 16903
16906 16905  H     11.807828   17.790080    5.784126     2 16903
16907 16906  O      8.923319    3.985865   30.503720     1 16907 16908
16908 16907  H      9.627493    4.634073   30.517776     2 16906
16909 16908  H      9.372996    3.142020   30.547856     2 16906
16910 16909  O     11.336667   10.012970   22.281368     1 16910 16911
16911 16910  H     10.879424    9.350196   21.763785     2 16909
16912 16911  H     11.734795    9.523022   23.000865     2 16909
16913 16912  O     14.133800   -5.026288   16.260543     1 16913 16914
16914 16913  H     14.189249   -4.380992   16.965347     2 16912
16915 16914  H     14.946860   -5.526783   16.328885     2 16912
16916 16915  O     15.552862   -1.880928   34.885077     1 16916 16917
16917 16916  H     15.162061   -1.022615   35.048796     2 16915
16918 16917  H     15.355624   -2.388524   35.672271     2 16915
16919 16918  O      1.487748   -7.303017    1.349366     1 16919 16920
16920 16919  H      1.188976   -6.577199    0.801502     2 16918
16921 16920  H      0.893541   -8.023231    1.138555     2 16918
16922 16921  O      3.884146   -1.360021   29.126274     1 16922 16923
16923 16922  H      3.755338   -0.411661   29.142162     2 16921
16924 16923  H      3.650376   -1.648776   30.008433     2 16921
16925 16924  O      8.169649   11.385374   31.480585     1 16925 16926
16926 16925  H      8.465078   11.948870   32.195725     2 16924
16927 16926  H      7.763823   10.636415   31.917159     2 16924
16928 16927  O     25.642179    3.706305    8.409041     1 16928 16929
16929 16928  H     24.858717    3.948402    7.915272     2 16927
16930 16929  H     25.501551    4.078216    9.279752     2 16927
16931 16930  O      3.631935    1.728102  -33.239192     1 16931 16932
16932 16931  H      3.487705    1.987352  -32.329127     2 16930
16933 16932  H      4.549965    1.941089  -33.406789     2 16930
16934 16933  O      5.949280   17.550956    9.918183     1 16934 16935
16935 16934  H      5.171115   17.543998    9.360830     2 16933
16936 16935  H      5.915750   18.395957   10.366603     2 16933
16937 16936  O      0.190769   18.224894   33.701397     1 16937 16938
16938 16937  H      0.201768   17.269145   33.649873     2 16936
16939 16938  H      0.316903   18.515393   32.798108     2 16936
16940 16939  O      9.144158  -30.884779    1.122567     1 16940 16941
16941 16940  H      9.833176  -30.762354    1.775634     2 16939
16942 16941  H      9.614609  -31.045640    0.304623     2 16939
16943 16942  O      4.757710    3.493235    9.715483     1 16943 16944
16944 16943  H      4.438813    3.468770   10.617668     2 16942
16945 16944  H      5.622823    3.898141    9.777633     2 16942
16946 16945  O      1.182638    4.621869   19.140730     1 16946 16947
16947 16946  H      0.786502    3.783316   18.903795     2 16945
16948 16947  H      1.854069    4.766975   18.474129     2 16945
16949 16948  O     17.517379   12.953861   19.796412     1 16949 16950
16950 16949  H     17.237009   13.641661   19.192628     2 16948
16951 16950  H     17.034468   13.131557   20.603537     2 16948
16952 16951  O      3.045842   12.474721   34.631846     1 16952 16953
16953 16952  H      2.112808   12.298065   34.752145     2 16951
16954 16953  H      3.484302   11.702291   34.988690     2 16951
16955 16954  O     10.162405   11.000635   -0.245303     1 16955 16956
16956 16955  H     10.581079   10.863316   -1.095060     2 16954
16957 16956  H     10.865417   10.874031    0.391861     2 16954
16958 16957  O     12.864669   26.700815   10.389798     1 16958 16959
16959 16958  H     12.552708   26.170924    9.656226     2 16957
16960 16959  H     13.816555   26.712442   10.289744     2 16957
16961 16960  O      1.153789   12.834496   12.652641     1 16961 16962
16962 16961  H      1.567776   12.205677   13.243769     2 16960
16963 16962  H      0.905861   13.566940   13.216813     2 16960
16964 16963  O     16.345484    3.618446    2.460956     1 16964 16965
16965 16964  H     15.696588    3.321390    1.823051     2 16963
16966 16965  H     15.883223    4.270464    2.987662     2 16963
16967 16966  O     16.417520   -5.373213   13.428049     1 16967 16968
16968 16967  H     15.996961   -6.102335   12.972260     2 16966
16969 16968  H     16.427498   -5.638756   14.347624     2 16966
16970 16969  O     16.711025   15.882272    8.578465     1 16970 16971
16971 16970  H     17.166102   16.423476    9.223629     2 16969
16972 16971  H     17.306160   15.150235    8.416699     2 16969
16973 16972  O      9.414474    6.132117    3.209680     1 16973 16974
16974 16973  H      8.505365    6.420728    3.129332     2 16972
16975 16974  H      9.353635    5.238609    3.547576     2 16972
16976 16975  O     18.014391   18.507892    0.463228     1 16976 16977
16977 16976  H     17.395733   19.236750    0.415682     2 16975
16978 16977  H     17.598997   17.807327   -0.039652     2 16975
16979 16978  O      6.933868    4.645245   32.398618     1 16979 16980
16980 16979  H      7.658963    4.726027   31.778987     2 16978
16981 16980  H      6.965548    5.452702   32.911689     2 16978
16982 16981  O     13.212454    5.654127    1.219264     1 16982 16983
16983 16982  H     13.594748    5.998178    2.026551     2 16981
16984 16983  H     13.858776    5.855879    0.542659     2 16981
16985 16984  O    -16.234371  -25.484380   -8.019565     1 16985 16986
16986 16985  H    -16.851763  -25.308963   -7.309433     2 16984
16987 16986  H    -15.378850  -25.516097   -7.591419     2 16984
16988 16987  O     28.677122    2.207442   13.031061     1 16988 16989
16989 16988  H     28.482833    1.836727   13.891906     2 16987
16990 16989  H     27.858707    2.120928   12.542242     2 16987
16991 16990  O      2.413815   27.902396   11.933957     1 16991 16992
16992 16991  H      1.540189   27.762327   12.299185     2 16990
16993 16992  H      2.326073   28.690062   11.397193     2 16990
16994 16993  O     17.485599    7.942454   13.506573     1 16994 16995
16995 16994  H     16.747076    7.936806   12.897652     2 16993
16996 16995  H     17.619062    8.867469   13.713375     2 16993
16997 16996  O     -3.290230    2.822587    4.828039     1 16997 16998
16998 16997  H     -2.802018    2.379761    4.133931     2 16996
16999 16998  H     -4.208744    2.642036    4.628126     2 16996
17000 16999  O      6.922370   16.999663   12.768795     1 17000 17001
17001 17000  H      6.809371   16.158369   12.326431     2 16999
17002 17001  H      6.444038   16.903918   13.592363     2 16999
17003 17002  O     16.113967    0.673673   30.659236     1 17003 17004
17004 17003  H     15.509556    0.305934   31.303974     2 17002
17005 17004  H     16.807792    0.019029   30.579982     2 17002
17006 17005  O     21.179745   17.046745   12.483157     1 17006 17007
17007 17006  H     21.725182   17.469105   11.819574     2 17005
17008 17007  H     21.011533   17.733614   13.128251     2 17005
17009 17008  O     11.448283    2.393618   22.035934     1 17009 17010
17010 17009  H     12.228212    2.007968   21.636913     2 17008
17011 17010  H     11.768798    2.809264   22.836397     2 17008
17012 17011  O     -4.580652  -27.803251  -21.951630     1 17012 17013
17013 17012  H     -4.544964  -27.029842  -22.514478     2 17011
17014 17013  H     -4.630636  -27.451206  -21.062924     2 17011
17015 17014  O      3.741904    2.002437   14.169399     1 17015 17016
17016 17015  H      3.549237    1.212003   13.665093     2 17014
17017 17016  H      2.985519    2.109437   14.746171     2 17014
17018 17017  O     12.486887   28.215273   12.689719     1 17018 17019
17019 17018  H     12.515970   27.457183   13.273402     2 17017
17020 17019  H     12.788115   27.879753   11.845373     2 17017
17021 17020  O      9.859287    0.394964    3.435881     1 17021 17022
17022 17021  H      9.374751   -0.275581    2.954397     2 17020
17023 17022  H     10.236460   -0.070880    4.182180     2 17020
17024 17023  O      7.084355    3.758314   22.662666     1 17024 17025
17025 17024  H      7.969146    4.058417   22.454549     2 17023
17026 17025  H      6.530401    4.525285   22.517328     2 17023
17027 17026  O     16.973019   23.607599   -4.159703     1 17027 17028
17028 17027  H     16.578989   23.083273   -3.462527     2 17026
17029 17028  H     17.716763   23.085898   -4.461205     2 17026
17030 17029  O     24.090805    0.408318   23.072006     1 17030 17031
17031 17030  H     24.992091    0.403166   23.394322     2 17029
17032 17031  H     23.913419    1.326993   22.870007     2 17029
17033 17032  O     25.712969    7.313684   18.481996     1 17033 17034
17034 17033  H     25.225314    7.098965   19.277181     2 17032
17035 17034  H     26.557475    6.876994   18.593097     2 17032
17036 17035  O      8.013531    5.583813   19.999852     1 17036 17037
17037 17036  H      8.447132    4.775903   20.274632     2 17035
17038 17037  H      8.458951    6.274224   20.490937     2 17035
17039 17038  O      6.772290   12.540663    0.121297     1 17039 17040
17040 17039  H      6.174069   12.322530    0.835986     2 17038
17041 17040  H      6.251251   13.083185   -0.470667     2 17038
17042 17041  O      9.556596   31.913188    4.581111     1 17042 17043
17043 17042  H      9.341427   32.719556    5.049836     2 17041
17044 17043  H     10.228851   32.173689    3.951473     2 17041
17045 17044  O     12.810229   17.054513    9.908339     1 17045 17046
17046 17045  H     13.216197   16.251202   10.234090     2 17044
17047 17046  H     13.253679   17.227851    9.077956     2 17044
17048 17047  O     13.751312    7.514426    3.112376     1 17048 17049
17049 17048  H     13.876758    6.948203    3.873880     2 17047
17050 17049  H     14.393638    8.214985    3.225809     2 17047
17051 17050  O      5.679853   12.320368   30.487677     1 17051 17052
17052 17051  H      6.631207   12.281019   30.585708     2 17050
17053 17052  H      5.535138   12.987293   29.816483     2 17050
17054 17053  O     17.160626   12.745527   22.505641     1 17054 17055
17055 17054  H     17.929283   12.221576   22.731193     2 17053
17056 17055  H     16.420655   12.150554   22.626815     2 17053
17057 17056  O     12.659435    6.660041   28.133955     1 17057 17058
17058 17057  H     11.902123    6.344866   27.640624     2 17056
17059 17058  H     13.227526    7.057169   27.473809     2 17056
17060 17059  O     11.141458    8.427537    2.698758     1 17060 17061
17061 17060  H     10.627050    7.622390    2.756673     2 17059
17062 17061  H     12.041733    8.149829    2.867918     2 17059
17063 17062  O     20.280117   11.982106    6.800321     1 17063 17064
17064 17063  H     20.432441   11.077170    7.072571     2 17062
17065 17064  H     20.742520   12.509700    7.451520     2 17062
17066 17065  O     19.574465    5.623262   20.166283     1 17066 17067
17067 17066  H     19.795587    6.166866   20.922479     2 17065
17068 17067  H     19.213058    6.237114   19.526907     2 17065
17069 17068  O      8.947595   -5.022867    3.079492     1 17069 17070
17070 17069  H      8.114746   -4.761289    3.472140     2 17068
17071 17070  H      8.851606   -4.812434    2.150657     2 17068
17072 17071  O    -35.912775   -0.631279   10.553061     1 17072 17073
17073 17072  H    -35.862995    0.104567   11.163213     2 17071
17074 17073  H    -35.942067   -0.223729    9.687454     2 17071
17075 17074  O     12.868636   -1.458889    3.646820     1 17075 17076
17076 17075  H     12.619413   -2.354668    3.419443     2 17074
17077 17076  H     12.782720   -1.420332    4.599376     2 17074
17078 17077  O     14.837040    2.709500    6.120459     1 17078 17079
17079 17078  H     14.671345    2.942119    7.034059     2 17077
17080 17079  H     15.695716    3.086536    5.928753     2 17077
17081 17080  O      5.000673   -2.455521    5.122764     1 17081 17082
17082 17081  H      5.898604   -2.136985    5.214883     2 17080
17083 17082  H      4.532779   -1.735440    4.699929     2 17080
17084 17083  O     16.832634    1.053835    1.848220     1 17084 17085
17085 17084  H     16.845454    1.862067    2.360889     2 17083
17086 17085  H     16.273045    0.460599    2.349382     2 17083
17087 17086  O     19.933898   14.380308   12.095217     1 17087 17088
17088 17087  H     20.300338   15.214021   12.389967     2 17086
17089 17088  H     19.803721   13.877693   12.899371     2 17086
17090 17089  O      9.608396   33.754315    6.698018     1 17090 17091
17091 17090  H     10.411321   33.363943    7.043203     2 17089
17092 17091  H      9.499438   34.562229    7.199651     2 17089
17093 17092  O      6.002323   14.508932   -1.840664     1 17093 17094
17094 17093  H      5.164713   14.103196   -2.064314     2 17092
17095 17094  H      5.769362   15.382055   -1.525042     2 17092
17096 17095  O     12.003897    9.239881   19.535632     1 17096 17097
17097 17096  H     11.650907    9.948580   18.997695     2 17095
17098 17097  H     12.197298    9.651418   20.377930     2 17095
17099 17098  O     10.199660    1.459016    7.623836     1 17099 17100
17100 17099  H     10.906037    1.093335    7.091351     2 17098
17101 17100  H     10.081242    2.347506    7.287986     2 17098
17102 17101  O     25.906911    8.795925   12.906722     1 17102 17103
17103 17102  H     25.043160    8.425495   12.725212     2 17101
17104 17103  H     25.730591    9.700547   13.165182     2 17101
17105 17104  O     20.794759   12.986275    9.471713     1 17105 17106
17106 17105  H     21.688393   13.325815    9.520316     2 17104
17107 17106  H     20.300821   13.520710   10.093514     2 17104
17108 17107  O      4.453131   13.643224   24.197630     1 17108 17109
17109 17108  H      5.069570   14.036146   23.579693     2 17107
17110 17109  H      4.656161   14.058362   25.035885     2 17107
17111 17110  O     20.018208    7.728816    3.055166     1 17111 17112
17112 17111  H     19.533191    6.930889    2.844686     2 17110
17113 17112  H     19.472770    8.177900    3.700962     2 17110
17114 17113  O     11.258299   23.754919    9.253334     1 17114 17115
17115 17114  H     11.930145   24.242520    8.776784     2 17113
17116 17115  H     10.536582   23.669415    8.630401     2 17113
17117 17116  O      9.261905   19.574465   18.399651     1 17117 17118
17118 17117  H      9.854451   20.220101   18.014587     2 17116
17119 17118  H      9.745844   19.219152   19.145163     2 17116
17120 17119  O    -19.545885  -23.683301   -8.234254     1 17120 17121
17121 17120  H    -19.994616  -24.035815   -9.002763     2 17119
17122 17121  H    -18.629974  -23.611714   -8.502979     2 17119
17123 17122  O     11.869778    2.752598    1.833925     1 17123 17124
17124 17123  H     11.116443    3.134896    2.283997     2 17122
17125 17124  H     12.418245    3.502744    1.604369     2 17122
17126 17125  O     15.096680   -3.059929   14.125119     1 17126 17127
17127 17126  H     14.440970   -3.496205   14.669122     2 17125
17128 17127  H     15.484912   -3.764209   13.605987     2 17125
17129 17128  O    -13.545217  -24.251667  -15.674457     1 17129 17130
17130 17129  H    -14.493817  -24.225570  -15.549121     2 17128
17131 17130  H    -13.360967  -25.157149  -15.924226     2 17128
17132 17131  O      4.610281   24.729128   18.911849     1 17132 17133
17133 17132  H      4.126584   24.145808   18.327037     2 17131
17134 17133  H      4.714803   25.538221   18.411174     2 17131
17135 17134  O     16.953620   15.217883   12.407670     1 17135 17136
17136 17135  H     16.985305   14.280567   12.599153     2 17134
17137 17136  H     17.860624   15.453855   12.213009     2 17134
17138 17137  O      1.294676   35.163374    1.180130     1 17138 17139
17139 17138  H      0.680156   35.866292    0.969173     2 17137
17140 17139  H      1.796400   35.033670    0.375343     2 17137
17141 17140  O     11.365147   11.903876   17.861372     1 17141 17142
17142 17141  H     11.422611   11.649438   16.940399     2 17140
17143 17142  H     11.171932   12.841124   17.839809     2 17140
17144 17143  O     19.099709   17.068087    7.481490     1 17144 17145
17145 17144  H     18.654837   16.330357    7.898714     2 17143
17146 17145  H     18.391682   17.648897    7.202943     2 17143
17147 17146  O      8.197105   11.028949   21.965623     1 17147 17148
17148 17147  H      8.719887   11.761409   22.291865     2 17146
17149 17148  H      8.115628   10.439523   22.715402     2 17146
17150 17149  O     18.640192    2.985601   20.358825     1 17150 17151
17151 17150  H     19.128187    3.807405   20.306563     2 17149
17152 17151  H     17.733624    3.232807   20.176466     2 17149
17153 17152  O     27.800292   15.018354    2.199513     1 17153 17154
17154 17153  H     27.564727   15.498994    1.405960     2 17152
17155 17154  H     27.861596   14.105564    1.917934     2 17152
17156 17155  O      8.611770   -4.301179   10.034742     1 17156 17157
17157 17156  H      8.701922   -5.218290   10.293605     2 17155
17158 17157  H      9.318546   -3.850718   10.497110     2 17155
17159 17158  O     12.267007    4.403996   23.948906     1 17159 17160
17160 17159  H     11.809584    5.095791   24.426834     2 17158
17161 17160  H     12.244692    3.650050   24.538228     2 17158
17162 17161  O     12.515980   20.778071   15.175097     1 17162 17163
17163 17162  H     12.345817   21.632690   14.778988     2 17161
17164 17163  H     12.232035   20.146460   14.514283     2 17161
17165 17164  O      4.364958  -35.258376   12.246660     1 17165 17166
17166 17165  H      4.594119  -34.409173   12.624246     2 17164
17167 17166  H      4.249613  -35.082550   11.312844     2 17164
17168 17167  O      0.936953   11.821573   25.494077     1 17168 17169
17169 17168  H      1.786478   12.210530   25.702045     2 17167
17170 17169  H      0.817919   11.990671   24.559482     2 17167
17171 17170  O    -19.049075  -34.255464   -0.053133     1 17171 17172
17172 17171  H    -18.872968  -34.231680    0.887426     2 17170
17173 17172  H    -19.373074  -33.378580   -0.258877     2 17170
17174 17173  O     20.680810    6.929407   22.275565     1 17174 17175
17175 17174  H     20.470074    7.554334   22.969315     2 17173
17176 17175  H     21.235114    6.275664   22.701709     2 17173
17177 17176  O      7.418864   16.045085    5.978207     1 17177 17178
17178 17177  H      7.232638   15.292704    6.539878     2 17176
17179 17178  H      6.867546   16.746216    6.325620     2 17176
17180 17179  O     -0.467857   27.752924   12.935756     1 17180 17181
17181 17180  H     -0.175988   28.643959   12.743138     2 17179
17182 17181  H     -1.238374   27.867742   13.491950     2 17179
17183 17182  O      5.922819    8.346733   25.347208     1 17183 17184
17184 17183  H      5.203633    8.175804   24.739108     2 17182
17185 17184  H      5.998598    7.542868   25.861300     2 17182
17186 17185  O     15.153343   28.815078    8.453819     1 17186 17187
17187 17186  H     14.284952   28.606336    8.109500     2 17185
17188 17187  H     15.290259   28.182589    9.159115     2 17185
17189 17188  O      8.049453    0.159999   28.607312     1 17189 17190
17190 17189  H      7.373088    0.173380   27.930125     2 17188
17191 17190  H      7.710695    0.731782   29.296179     2 17188
17192 17191  O      1.217979  -33.392820   11.599295     1 17192 17193
17193 17192  H      0.441993  -32.990929   11.989885     2 17191
17194 17193  H      1.921915  -33.210059   12.221633     2 17191
17195 17194  O     16.889805    5.323502   14.162021     1 17195 17196
17196 17195  H     17.084625    6.053064   13.573789     2 17194
17197 17196  H     17.624456    4.720567   14.048057     2 17194
17198 17197  O    -16.033659  -28.328134   -8.975995     1 17198 17199
17199 17198  H    -15.356203  -28.114659   -9.617644     2 17197
17200 17199  H    -16.265496  -27.486760   -8.582838     2 17197
17201 17200  O      9.472893    7.683321   28.235718     1 17201 17202
17202 17201  H      9.501175    7.985818   29.143422     2 17200
17203 17202  H      9.063760    8.403197   27.755489     2 17200
17204 17203  O    -22.393505  -18.762279   -9.567014     1 17204 17205
17205 17204  H    -23.132660  -18.761171   -8.958835     2 17203
17206 17205  H    -21.984552  -19.619238   -9.446140     2 17203
17207 17206  O    -21.848585  -12.653675  -16.741055     1 17207 17208
17208 17207  H    -21.851359  -12.803140  -17.686510     2 17206
17209 17208  H    -21.598278  -13.497742  -16.365384     2 17206
17210 17209  O     11.194384    0.188154   10.379505     1 17210 17211
17211 17210  H     11.301937   -0.317604    9.573979     2 17209
17212 17211  H     10.270216    0.437389   10.384802     2 17209
17213 17212  O      3.394465   11.309561   28.026894     1 17213 17214
17214 17213  H      4.211920   11.331418   28.524408     2 17212
17215 17214  H      3.655456   11.032939   27.148490     2 17212
17216 17215  O      2.588589   19.928664   17.005283     1 17216 17217
17217 17216  H      2.638860   19.105894   16.518708     2 17215
17218 17217  H      2.617009   20.608024   16.331566     2 17215
17219 17218  O    -35.729906    1.135824   14.577992     1 17219 17220
17220 17219  H    -35.610495    0.738826   15.440758     2 17218
17221 17220  H    -36.646025    0.964585   14.359737     2 17218
17222 17221  O     15.634378    2.202816   11.919378     1 17222 17223
17223 17222  H     15.257543    1.349288   12.133191     2 17221
17224 17223  H     15.035767    2.573851   11.271127     2 17221
17225 17224  O      3.772644   -5.598994   10.405887     1 17225 17226
17226 17225  H      2.879797   -5.751568   10.096409     2 17224
17227 17226  H      3.675657   -4.962437   11.114139     2 17224
17228 17227  O      5.081401   26.283327    6.906147     1 17228 17229
17229 17228  H      5.144774   25.692630    7.656675     2 17227
17230 17229  H      5.740630   26.956647    7.074342     2 17227
17231 17230  O     15.022158    9.991207    2.432719     1 17231 17232
17232 17231  H     14.956956   10.140513    1.489486     2 17230
17233 17232  H     15.874216   10.354015    2.674790     2 17230
17234 17233  O      4.253315    9.013822  -34.076258     1 17234 17235
17235 17234  H      4.369964    9.306318  -33.172339     2 17233
17236 17235  H      3.310485    8.873357  -34.163269     2 17233
17237 17236  O     12.674100    3.792166   28.567573     1 17237 17238
17238 17237  H     11.988201    4.379475   28.250015     2 17236
17239 17238  H     13.178375    4.323228   29.183942     2 17236
17240 17239  O     22.066222   24.983475    1.153557     1 17240 17241
17241 17240  H     22.935531   24.583401    1.175332     2 17239
17242 17241  H     21.531715   24.427078    1.720087     2 17239
17243 17242  O    -23.971119  -18.846559   -7.294918     1 17243 17244
17244 17243  H    -23.559553  -18.945558   -6.436405     2 17242
17245 17244  H    -24.324672  -17.957059   -7.290429     2 17242
17246 17245  O     20.107522    9.042160    7.023206     1 17246 17247
17247 17246  H     21.016961    8.744868    6.995445     2 17245
17248 17247  H     19.897930    9.086581    7.956120     2 17245
17249 17248  O      0.503869   15.338848   33.668459     1 17249 17250
17250 17249  H     -0.238666   14.738779   33.737674     2 17248
17251 17250  H      1.022802   14.995622   32.941041     2 17248
17252 17251  O      7.698857   30.287322    5.965035     1 17252 17253
17253 17252  H      8.478635   30.744909    5.650724     2 17251
17254 17253  H      7.156028   30.975085    6.350456     2 17251
17255 17254  O      1.948592   24.416521   20.557937     1 17255 17256
17256 17255  H      1.482273   24.884101   19.865011     2 17254
17257 17256  H      2.185601   25.096367   21.188706     2 17254
17258 17257  O      5.922403    6.032077   26.917942     1 17258 17259
17259 17258  H      6.173450    5.711625   27.784266     2 17257
17260 17259  H      5.146923    5.520164   26.688145     2 17257
17261 17260  O      7.627573   -1.908711    4.745676     1 17261 17262
17262 17261  H      8.004318   -2.389657    5.482553     2 17260
17263 17262  H      8.197089   -2.118861    4.005595     2 17260
17264 17263  O     -6.889577    8.693801  -36.017862     1 17264 17265
17265 17264  H     -6.406311    8.519333  -35.210245     2 17263
17266 17265  H     -7.388674    7.892616  -36.176725     2 17263
17267 17266  O     19.110045   -2.581653   11.199702     1 17267 17268
17268 17267  H     18.995334   -3.526683   11.299652     2 17266
17269 17268  H     19.643367   -2.323792   11.951572     2 17266
17270 17269  O     11.511556   -2.262135    8.374322     1 17270 17271
17271 17270  H     12.280477   -2.013535    7.861302     2 17269
17272 17271  H     11.610551   -3.203883    8.514115     2 17269
17273 17272  O      2.922102   32.129128   12.996818     1 17273 17274
17274 17273  H      3.248329   33.015446   13.152535     2 17272
17275 17274  H      2.659302   31.814697   13.861862     2 17272
17276 17275  O      3.751288    4.779824   31.491020     1 17276 17277
17277 17276  H      4.589458    4.342249   31.341919     2 17275
17278 17277  H      3.344892    4.284125   32.201904     2 17275
17279 17278  O    -30.252003   -8.909746   -1.578636     1 17279 17280
17280 17279  H    -30.324805   -9.481448   -2.342892     2 17278
17281 17280  H    -31.153644   -8.654988   -1.382744     2 17278
17282 17281  O      5.427351   19.137230    3.718063     1 17282 17283
17283 17282  H      5.809593   20.014002    3.755376     2 17281
17284 17283  H      4.734456   19.205260    3.061177     2 17281
17285 17284  O     -1.242890   33.273739   13.907475     1 17285 17286
17286 17285  H     -1.875660   32.882035   14.509472     2 17284
17287 17286  H     -0.496301   33.504017   14.460474     2 17284
17288 17287  O     16.636523   16.540117    4.636576     1 17288 17289
17289 17288  H     17.552291   16.551965    4.358259     2 17287
17290 17289  H     16.595983   17.170885    5.355409     2 17287
17291 17290  O     19.209624    1.731965   22.667351     1 17291 17292
17292 17291  H     19.502041    0.956101   22.189064     2 17290
17293 17292  H     19.069429    2.393080   21.989485     2 17290
17294 17293  O      9.407972   13.082211   13.981420     1 17294 17295
17295 17294  H     10.347809   12.969466   13.839201     2 17293
17296 17295  H      9.186614   12.432675   14.648754     2 17293
17297 17296  O     12.659492    7.928334   16.914346     1 17297 17298
17298 17297  H     12.698998    8.512343   17.671713     2 17296
17299 17298  H     12.138005    7.183214   17.212804     2 17296
17300 17299  O      8.491445    0.957828   17.648528     1 17300 17301
17301 17300  H      9.204671    1.024135   17.013592     2 17299
17302 17301  H      8.920618    1.035825   18.500560     2 17299
17303 17302  O      3.056139    3.200840   26.318243     1 17303 17304
17304 17303  H      3.918234    3.080594   25.920042     2 17302
17305 17304  H      3.032769    4.125292   26.565374     2 17302
17306 17305  O      3.407280   17.980356   -1.773672     1 17306 17307
17307 17306  H      2.508387   18.266017   -1.610515     2 17305
17308 17307  H      3.756222   18.625500   -2.388700     2 17305
17309 17308  O     10.769309   18.447668   20.511547     1 17309 17310
17310 17309  H     11.102602   17.555719   20.609391     2 17308
17311 17310  H     11.299694   18.969461   21.113758     2 17308
17312 17311  O     12.709417  -35.849850    1.265431     1 17312 17313
17313 17312  H     13.481832  -36.350235    1.002332     2 17311
17314 17313  H     12.693606  -35.101490    0.668825     2 17311
17315 17314  O     12.637109    1.808990   12.217527     1 17315 17316
17316 17315  H     12.680985    0.919816   11.865851     2 17314
17317 17316  H     11.723919    2.069671   12.097696     2 17314
17318 17317  O      7.162205    9.502566   28.188923     1 17318 17319
17319 17318  H      7.535628   10.334944   28.478637     2 17317
17320 17319  H      6.680638    9.720396   27.390879     2 17317
17321 17320  O     15.289824   18.454256   18.270326     1 17321 17322
17322 17321  H     15.423110   18.000688   19.102637     2 17320
17323 17322  H     14.686455   17.891958   17.784528     2 17320
17324 17323  O    -28.682682  -21.185567    1.614196     1 17324 17325
17325 17324  H    -28.262545  -21.696569    0.922391     2 17323
17326 17325  H    -29.587186  -21.080312    1.319192     2 17323
17327 17326  O     21.920227   -0.443043   16.794553     1 17327 17328
17328 17327  H     21.723743   -0.749180   17.679937     2 17326
17329 17328  H     22.853990   -0.233497   16.814773     2 17326
17330 17329  O    -34.811247  -16.474709    1.047626     1 17330 17331
17331 17330  H    -35.602035  -15.974420    0.846140     2 17329
17332 17331  H    -34.573928  -16.201825    1.933879     2 17329
17333 17332  O      1.231013    3.675875    5.286581     1 17333 17334
17334 17333  H      1.726800    2.980759    5.719296     2 17332
17335 17334  H      0.314145    3.435810    5.420578     2 17332
17336 17335  O      7.433648   14.256241   12.445484     1 17336 17337
17337 17336  H      8.250573   14.004004   12.875881     2 17335
17338 17337  H      7.695217   14.498191   11.557074     2 17335
17339 17338  O      6.233328    2.375961   33.666650     1 17339 17340
17340 17339  H      7.064578    2.304227   34.135807     2 17338
17341 17340  H      6.388863    3.049360   33.004400     2 17338
17342 17341  O     -2.883586   28.260540   20.742187     1 17342 17343
17343 17342  H     -3.247604   28.790943   21.450984     2 17341
17344 17343  H     -3.327744   28.574939   19.954718     2 17341
17345 17344  O     10.500851   -1.181888    5.700345     1 17345 17346
17346 17345  H     10.221948   -1.631286    6.498145     2 17344
17347 17346  H     11.137940   -0.533541    6.000340     2 17344
17348 17347  O     22.817713   18.325078   10.685803     1 17348 17349
17349 17348  H     22.236511   18.597600    9.975755     2 17347
17350 17349  H     23.544824   17.885175   10.245318     2 17347
17351 17350  O     -0.097226   29.654382    3.105948     1 17351 17352
17352 17351  H     -0.213211   29.793420    4.045867     2 17350
17353 17352  H      0.014037   28.708005    3.015271     2 17350
17354 17353  O      4.008318   10.118071   35.758290     1 17354 17355
17355 17354  H      4.673161   10.183821   35.072803     2 17353
17356 17355  H      4.494032    9.851849   36.538955     2 17353
17357 17356  O      4.560835   32.145771    9.255903     1 17357 17358
17358 17357  H      4.676214   33.028983    9.606411     2 17356
17359 17358  H      3.612585   32.039886    9.179474     2 17356
17360 17359  O     16.357891   13.684148    5.370890     1 17360 17361
17361 17360  H     17.154022   13.344007    5.779192     2 17359
17362 17361  H     16.507588   14.627049    5.301884     2 17359
17363 17362  O     23.141719   13.062695    2.601484     1 17363 17364
17364 17363  H     23.735505   13.612730    3.112475     2 17362
17365 17364  H     23.711617   12.601713    1.985900     2 17362
17366 17365  O     12.174175    8.817894    6.603221     1 17366 17367
17367 17366  H     11.231035    8.981338    6.600998     2 17365
17368 17367  H     12.547773    9.561811    6.130735     2 17365
17369 17368  O    -18.839441  -29.836480   -2.625807     1 17369 17370
17370 17369  H    -19.258504  -29.043230   -2.959531     2 17368
17371 17370  H    -18.984625  -30.490423   -3.309555     2 17368
17372 17371  O    -29.270306   -6.713213  -15.870038     1 17372 17373
17373 17372  H    -28.492818   -7.030263  -16.329629     2 17371
17374 17373  H    -29.999977   -7.167671  -16.291084     2 17371
17375 17374  O      3.628583   31.770839   17.004224     1 17375 17376
17376 17375  H      3.226152   31.091715   17.545585     2 17374
17377 17376  H      4.413551   31.357449   16.644827     2 17374
17378 17377  O      5.886049    8.389282   16.203832     1 17378 17379
17379 17378  H      5.520275    8.569344   17.069868     2 17377
17380 17379  H      6.502966    7.671808   16.348314     2 17377
17381 17380  O     18.374252   14.061249    7.642077     1 17381 17382
17382 17381  H     19.262594   13.832340    7.368801     2 17380
17383 17382  H     17.928162   13.219739    7.737454     2 17380
17384 17383  O     11.937243   12.743129   22.505513     1 17384 17385
17385 17384  H     11.626921   11.838038   22.478257     2 17383
17386 17385  H     12.770020   12.725608   22.033912     2 17383
17387 17386  O     26.048826   12.531775   15.140019     1 17387 17388
17388 17387  H     26.241615   12.075846   15.959282     2 17386
17389 17388  H     26.855819   12.460706   14.630173     2 17386
17390 17389  O    -35.016273    4.402628    7.631633     1 17390 17391
17391 17390  H    -35.040809    4.592066    6.693687     2 17389
17392 17391  H    -34.159848    3.999036    7.772629     2 17389
17393 17392  O     12.878852   28.439854    2.261819     1 17393 17394
17394 17393  H     12.812108   29.089469    2.961660     2 17392
17395 17394  H     13.641667   28.713416    1.752399     2 17392
17396 17395  O      2.621568   13.981112   28.412583     1 17396 17397
17397 17396  H      1.713950   14.210589   28.213078     2 17395
17398 17397  H      2.695933   13.059356   28.165464     2 17395
17399 17398  O     12.003145   11.241183    1.870121     1 17399 17400
17400 17399  H     11.765673   10.408440    2.278016     2 17398
17401 17400  H     11.826752   11.897507    2.544181     2 17398
17402 17401  O    -16.231183  -30.464989   -7.106581     1 17402 17403
17403 17402  H    -16.461359  -31.227343   -7.637682     2 17401
17404 17403  H    -16.376401  -29.716581   -7.685398     2 17401
17405 17404  O     20.820970    0.603315   14.585037     1 17405 17406
17406 17405  H     21.296477    0.259635   15.341350     2 17404
17407 17406  H     20.679813   -0.159012   14.023642     2 17404
17408 17407  O      4.667927   23.398973   22.780821     1 17408 17409
17409 17408  H      4.118658   24.179149   22.704256     2 17407
17410 17409  H      4.853880   23.146690   21.876385     2 17407
17411 17410  O      6.458787   -4.744291    4.099658     1 17411 17412
17412 17411  H      6.452394   -3.808375    4.300283     2 17410
17413 17412  H      5.603475   -5.058436    4.392889     2 17410
17414 17413  O    -28.806033  -21.276595   -3.237163     1 17414 17415
17415 17414  H    -29.626855  -21.696867   -2.980542     2 17413
17416 17415  H    -28.818610  -20.431307   -2.788207     2 17413
17417 17416  O     15.303910    4.222942   -1.564978     1 17417 17418
17418 17417  H     15.237982    3.533300   -0.904463     2 17416
17419 17418  H     14.983446    3.815815   -2.369827     2 17416
17420 17419  O     14.154570   15.814203    4.586975     1 17420 17421
17421 17420  H     14.211986   15.455843    3.701248     2 17419
17422 17421  H     15.019860   16.189324    4.750648     2 17419
17423 17422  O    -28.744151  -16.857223   -7.590012     1 17423 17424
17424 17423  H    -28.254210  -17.223764   -6.853917     2 17422
17425 17424  H    -28.790513  -17.570657   -8.226483     2 17422
17426 17425  O     22.753393   13.648450    6.533507     1 17426 17427
17427 17426  H     22.164381   14.401354    6.484185     2 17425
17428 17427  H     23.602989   14.023219    6.765819     2 17425
17429 17428  O      4.104184   13.736253   15.586069     1 17429 17430
17430 17429  H      3.926483   13.911411   14.661961     2 17428
17431 17430  H      3.569200   12.969757   15.792241     2 17428
17432 17431  O     15.216320   20.428405    4.035855     1 17432 17433
17433 17432  H     15.477643   19.582204    3.672693     2 17431
17434 17433  H     14.336409   20.279572    4.382029     2 17431
17435 17434  O      1.624347   11.249996    0.689479     1 17435 17436
17436 17435  H      2.268057   10.915864    0.064800     2 17434
17437 17436  H      1.860462   12.169956    0.808448     2 17434
17438 17437  O     25.518851   17.976771   10.034070     1 17438 17439
17439 17438  H     25.371321   18.705530   10.636879     2 17437
17440 17439  H     26.387697   18.140748    9.667396     2 17437
17441 17440  O      1.884397   13.410592  -27.317842     1 17441 17442
17442 17441  H      2.828030   13.445269  -27.161046     2 17440
17443 17442  H      1.648581   12.496167  -27.161479     2 17440
17444 17443  O      9.337091    2.690464   26.747899     1 17444 17445
17445 17444  H      9.610756    3.595999   26.893998     2 17443
17446 17445  H      8.564280    2.760754   26.187493     2 17443
17447 17446  O     10.091056   17.801088   16.321949     1 17447 17448
17448 17447  H      9.430416   17.191233   15.993524     2 17446
17449 17448  H      9.645584   18.286318   17.016455     2 17446
17450 17449  O     19.617141    8.735200   16.976866     1 17450 17451
17451 17450  H     20.521196    8.425651   16.921216     2 17449
17452 17451  H     19.657446    9.489260   17.565085     2 17449
17453 17452  O      4.948584   33.942142   15.269123     1 17453 17454
17454 17453  H      5.849564   33.671005   15.445053     2 17452
17455 17454  H      4.413995   33.370549   15.820237     2 17452
17456 17455  O     14.559834   18.014627   14.085041     1 17456 17457
17457 17456  H     14.563854   18.966141   13.980938     2 17455
17458 17457  H     14.844779   17.679011   13.235100     2 17455
17459 17458  O     30.091751    6.690133    7.864168     1 17459 17460
17460 17459  H     30.730502    7.175635    8.386199     2 17458
17461 17460  H     29.272269    6.770292    8.352282     2 17458
17462 17461  O     14.189041    7.635386   21.781716     1 17462 17463
17463 17462  H     14.413085    6.737867   22.027676     2 17461
17464 17463  H     13.635504    7.949129   22.496834     2 17461
17465 17464  O      0.380659    0.069905   20.910155     1 17465 17466
17466 17465  H     -0.349022    0.587756   21.250193     2 17464
17467 17466  H      0.053151   -0.829481   20.901497     2 17464
17468 17467  O    -21.221660  -23.397166   -6.150022     1 17468 17469
17469 17468  H    -20.648827  -23.399664   -6.916891     2 17467
17470 17469  H    -21.443016  -24.318256   -6.012818     2 17467
17471 17470  O     11.902186   13.676498    8.930977     1 17471 17472
17472 17471  H     12.675673   13.990514    8.462636     2 17470
17473 17472  H     11.376468   13.240084    8.260608     2 17470
17474 17473  O     10.140371    7.896411   20.928834     1 17474 17475
17475 17474  H     10.574826    7.095851   21.223085     2 17473
17476 17475  H     10.601320    8.138254   20.125546     2 17473
17477 17476  O     23.075767    7.704712   14.403615     1 17477 17478
17478 17477  H     22.834785    7.987010   15.285923     2 17476
17479 17478  H     23.536245    6.875781   14.534246     2 17476
17480 17479  O     14.987160    7.357738   30.340756     1 17480 17481
17481 17480  H     14.358744    6.967553   29.733235     2 17479
17482 17481  H     15.191701    6.655559   30.958281     2 17479
17483 17482  O    -19.493551   -0.862003  -32.438433     1 17483 17484
17484 17483  H    -18.973976   -1.038397  -33.222753     2 17482
17485 17484  H    -20.205247   -1.501147  -32.473268     2 17482
17486 17485  O     21.153798   18.830675    3.526583     1 17486 17487
17487 17486  H     21.825153   18.242838    3.872937     2 17485
17488 17487  H     21.572059   19.691560    3.513710     2 17485
17489 17488  O      4.803240   26.643284   11.331513     1 17489 17490
17490 17489  H      3.944708   26.909718   11.660400     2 17488
17491 17490  H      5.422887   27.208775   11.792477     2 17488
17492 17491  O     16.606002    9.913324   17.616391     1 17492 17493
17493 17492  H     17.395936   10.088866   18.127684     2 17491
17494 17493  H     16.119855    9.274363   18.137564     2 17491
17495 17494  O      2.096754   15.543377  -33.314664     1 17495 17496
17496 17495  H      1.325800   15.912976  -33.745081     2 17494
17497 17496  H      1.781502   15.265974  -32.454492     2 17494
17498 17497  O      6.976371   -4.246008   -1.876263     1 17498 17499
17499 17498  H      7.405172   -5.042825   -1.564102     2 17497
17500 17499  H      7.520636   -3.950796   -2.606233     2 17497
17501 17500  O     13.324900    1.288839   14.690702     1 17501 17502
17502 17501  H     12.929753    1.669282   13.906257     2 17500
17503 17502  H     14.178961    0.970125   14.398755     2 17500
17504 17503  O      2.120236   26.736612    4.372516     1 17504 17505
17505 17504  H      2.691382   27.339867    3.897008     2 17503
17506 17505  H      1.310053   26.721264    3.863006     2 17503
17507 17506  O      8.103912   10.907284   15.102727     1 17507 17508
17508 17507  H      7.751269   11.118518   14.238289     2 17506
17509 17508  H      8.036145    9.954408   15.163268     2 17506
17510 17509  O    -30.963175  -13.315088   -1.308569     1 17510 17511
17511 17510  H    -30.056206  -13.113569   -1.078287     2 17509
17512 17511  H    -31.475308  -12.617497   -0.899525     2 17509
17513 17512  O     10.469472    1.267352   16.160995     1 17513 17514
17514 17513  H     10.981868    0.586089   15.725609     2 17512
17515 17514  H     10.933555    2.080596   15.962268     2 17512
17516 17515  O      9.196425   -1.212134   33.937818     1 17516 17517
17517 17516  H      8.733178   -0.903148   34.716382     2 17515
17518 17517  H      9.013503   -2.151174   33.906602     2 17515
17519 17518  O      5.322740    0.212771   10.053196     1 17519 17520
17520 17519  H      4.502748    0.705957   10.028436     2 17518
17521 17520  H      6.000178    0.864219    9.871747     2 17518
17522 17521  O     13.251416   17.459227   16.619205     1 17522 17523
17523 17522  H     13.556723   17.375874   15.715838     2 17521
17524 17523  H     12.307939   17.600844   16.541564     2 17521
17525 17524  O    -18.155424  -25.944206   -6.249968     1 17525 17526
17526 17525  H    -18.176643  -26.886733   -6.415570     2 17524
17527 17526  H    -18.996602  -25.624264   -6.575986     2 17524
17528 17527  O      1.382135   -4.091165    3.093925     1 17528 17529
17529 17528  H      0.775726   -4.671341    3.554245     2 17527
17530 17529  H      0.894382   -3.275405    2.980505     2 17527
17531 17530  O      7.941276   11.019591   35.350456     1 17531 17532
17532 17531  H      7.236882   10.843890   34.726604     2 17530
17533 17532  H      8.608087   11.475908   34.837262     2 17530
17534 17533  O     15.972435    8.059903   19.637943     1 17534 17535
17535 17534  H     16.161213    7.292466   19.097911     2 17533
17536 17535  H     15.147593    7.848617   20.075237     2 17533
17537 17536  O     27.853946    6.772216    9.820910     1 17537 17538
17538 17537  H     27.924191    7.545184   10.381106     2 17536
17539 17538  H     27.613455    6.063981   10.418237     2 17536
17540 17539  O     10.125441   11.828641    7.084171     1 17540 17541
17541 17540  H      9.319527   12.295623    7.304764     2 17539
17542 17541  H      9.891357   10.902688    7.147801     2 17539
17543 17542  O      7.121905   26.435178    2.342662     1 17543 17544
17544 17543  H      7.150348   27.204912    2.910933     2 17542
17545 17544  H      7.821487   26.581036    1.705841     2 17542
17546 17545  O     13.217417    6.193193   12.655954     1 17546 17547
17547 17546  H     13.792059    5.773292   12.015875     2 17545
17548 17547  H     13.125089    5.546879   13.355943     2 17545
17549 17548  O     -2.667013    7.681970   24.949711     1 17549 17550
17550 17549  H     -3.572173    7.984001   25.025166     2 17548
17551 17550  H     -2.624573    7.263378   24.089936     2 17548
17552 17551  O     15.329838   10.983328   20.402944     1 17552 17553
17553 17552  H     14.786425   10.648761   19.689503     2 17551
17554 17553  H     16.106256   11.335993   19.968164     2 17551
17555 17554  O     -0.498181   36.225144    6.334916     1 17555 17556
17556 17555  H     -0.042343   36.999428    6.664958     2 17554
17557 17556  H     -1.421071   36.389113    6.528873     2 17554
17558 17557  O      2.025091   -2.080959   17.386809     1 17558 17559
17559 17558  H      1.136626   -1.846932   17.655309     2 17557
17560 17559  H      2.303085   -2.738604   18.024345     2 17557
17561 17560  O     18.945498    1.259356   33.924633     1 17561 17562
17562 17561  H     19.253470    0.590025   34.535682     2 17560
17563 17562  H     17.990929    1.206404   33.971803     2 17560
17564 17563  O      8.619264    9.467600   17.483290     1 17564 17565
17565 17564  H      8.636072   10.063700   16.734548     2 17563
17566 17565  H      8.024674    9.883301   18.107700     2 17563
17567 17566  O      3.420554    6.906463   29.423871     1 17567 17568
17568 17567  H      4.251660    7.302712   29.685558     2 17566
17569 17568  H      3.384831    6.081703   29.908357     2 17566
17570 17569  O      9.037678    6.654312   17.555861     1 17570 17571
17571 17570  H      9.015634    7.610510   17.518043     2 17569
17572 17571  H      8.450260    6.429063   18.277273     2 17569
17573 17572  O      5.063340    8.665340   18.759369     1 17573 17574
17574 17573  H      5.523660    9.429453   19.106455     2 17572
17575 17574  H      4.580226    8.315662   19.508073     2 17572
17576 17575  O     31.323055   11.827915    1.964640     1 17576 17577
17577 17576  H     30.378289   11.681260    1.918360     2 17575
17578 17577  H     31.538208   11.716029    2.890611     2 17575
17579 17578  O      6.915008    7.142782    3.884548     1 17579 17580
17580 17579  H      6.925071    7.998667    3.456072     2 17578
17581 17580  H      6.024665    7.055258    4.224930     2 17578
17582 17581  O      4.552914   14.633573    1.889574     1 17582 17583
17583 17582  H      4.694053   13.690436    1.972056     2 17581
17584 17583  H      5.291118   15.028212    2.353844     2 17581
17585 17584  O      7.955781    5.211534   25.250116     1 17585 17586
17586 17585  H      7.428817    4.793221   24.569268     2 17584
17587 17586  H      7.316833    5.645980   25.815124     2 17584
17588 17587  O      3.040836    6.313256    7.937617     1 17588 17589
17589 17588  H      2.682238    6.203115    8.818247     2 17587
17590 17589  H      3.675208    5.602313    7.846165     2 17587
17591 17590  O     10.319675    3.726796    6.183126     1 17591 17592
17592 17591  H     11.040363    4.349292    6.279769     2 17590
17593 17592  H     10.193363    3.650843    5.237342     2 17590
17594 17593  O      9.330774   32.616982   -3.605843     1 17594 17595
17595 17594  H      8.857607   33.225369   -3.038209     2 17593
17596 17595  H     10.250759   32.733609   -3.368655     2 17593
17597 17596  O     12.871176    9.250440   11.334228     1 17597 17598
17598 17597  H     12.562102    9.876706   10.679632     2 17596
17599 17598  H     13.240983    8.531102   10.822343     2 17596
17600 17599  O    -12.548115  -29.880624   -5.908756     1 17600 17601
17601 17600  H    -12.314611  -28.979292   -5.686700     2 17599
17602 17601  H    -12.843163  -30.262686   -5.082193     2 17599
17603 17602  O     19.769813   17.259095   -1.972053     1 17603 17604
17604 17603  H     20.599609   17.406173   -1.518139     2 17602
17605 17604  H     19.189540   16.899798   -1.300920     2 17602
17606 17605  O     11.621962   15.698095   21.847821     1 17606 17607
17607 17606  H     12.504926   15.825284   21.500793     2 17605
17608 17607  H     11.647408   14.833421   22.257605     2 17605
17609 17608  O     28.160877   10.856191    4.862211     1 17609 17610
17610 17609  H     27.944835    9.944510    5.058159     2 17608
17611 17610  H     28.372882   10.857300    3.928785     2 17608
17612 17611  O     19.559546   -0.391408   24.828825     1 17612 17613
17613 17612  H     19.747557    0.279030   24.172018     2 17611
17614 17613  H     20.402326   -0.817583   24.984797     2 17611
17615 17614  O     14.632395   10.473279   15.395233     1 17615 17616
17616 17615  H     14.232268    9.608052   15.308553     2 17614
17617 17616  H     15.359266   10.341649   16.003971     2 17614
17618 17617  O      4.751928   17.457379    0.605310     1 17618 17619
17619 17618  H      4.212076   16.802723    1.048274     2 17617
17620 17619  H      4.421720   17.472746   -0.292999     2 17617
17621 17620  O      6.934765  -34.600922    5.835773     1 17621 17622
17622 17621  H      7.046628  -34.885752    4.928805     2 17620
17623 17622  H      7.054850  -33.651758    5.805781     2 17620
17624 17623  O     -0.840624   24.713921   -1.265248     1 17624 17625
17625 17624  H     -0.294764   24.823346   -2.043898     2 17623
17626 17625  H     -1.713842   24.525191   -1.608908     2 17623
17627 17626  O      0.148804   -2.187485   30.572777     1 17627 17628
17628 17627  H      0.749584   -2.236443   29.829206     2 17626
17629 17628  H      0.531147   -2.770088   31.228993     2 17626
17630 17629  O    -23.177754  -23.328347    3.357475     1 17630 17631
17631 17630  H    -22.231914  -23.474832    3.370089     2 17629
17632 17631  H    -23.272696  -22.383657    3.235912     2 17629
17633 17632  O     13.603199    1.035454   17.596413     1 17633 17634
17634 17633  H     13.251017    0.169481   17.802057     2 17632
17635 17634  H     13.702414    1.034290   16.644369     2 17632
17636 17635  O      7.231009   11.197507   12.532785     1 17636 17637
17637 17636  H      6.987792   10.448482   11.988690     2 17635
17638 17637  H      6.989104   11.962227   12.010371     2 17635
17639 17638  O     17.498039    3.675302    6.622542     1 17639 17640
17640 17639  H     17.636634    4.523958    7.043025     2 17638
17641 17640  H     17.945189    3.049359    7.192176     2 17638
17642 17641  O    -32.704238  -12.979747   -3.875851     1 17642 17643
17643 17642  H    -31.904757  -13.490488   -3.748547     2 17641
17644 17643  H    -33.344899  -13.613341   -4.198872     2 17641
17645 17644  O      7.169703   20.335966    6.367877     1 17645 17646
17646 17645  H      7.168552   19.879528    7.209241     2 17644
17647 17646  H      7.646337   19.751498    5.778429     2 17644
17648 17647  O      8.718588   13.241005   19.778868     1 17648 17649
17649 17648  H      9.502066   13.559718   19.330741     2 17647
17650 17649  H      8.924824   12.334668   20.007454     2 17647
17651 17650  O    -27.036151  -23.488865   -2.918418     1 17651 17652
17652 17651  H    -26.112229  -23.328362   -3.110350     2 17650
17653 17652  H    -27.258912  -22.839794   -2.251099     2 17650
17654 17653  O     11.533406    5.657195   18.391958     1 17654 17655
17655 17654  H     11.522193    5.793901   19.339280     2 17653
17656 17655  H     10.610375    5.657566   18.138489     2 17653
17657 17656  O      4.092055    4.095301   12.212932     1 17657 17658
17658 17657  H      3.752715    3.565568   12.934364     2 17656
17659 17658  H      4.853960    4.542555   12.581301     2 17656
17660 17659  O      6.759186    5.169448   10.242630     1 17660 17661
17661 17660  H      6.834391    5.967795   10.765331     2 17659
17662 17661  H      6.766479    5.474935    9.335516     2 17659
17663 17662  O     10.501508    6.024884    0.490414     1 17663 17664
17664 17663  H     11.410933    5.884161    0.753804     2 17662
17665 17664  H     10.044993    6.232873    1.305623     2 17662
17666 17665  O     12.145117    5.788509   21.176464     1 17666 17667
17667 17666  H     12.936391    6.323173   21.111258     2 17665
17668 17667  H     12.313509    5.199333   21.911819     2 17665
17669 17668  O     10.024509    8.979843   25.314970     1 17669 17670
17670 17669  H      9.245716    9.114890   24.775085     2 17668
17671 17670  H     10.191008    9.833868   25.713907     2 17668
17672 17671  O     28.154055    4.773770   11.998361     1 17672 17673
17673 17672  H     28.487428    5.615759   12.308438     2 17671
17674 17673  H     28.608688    4.123677   12.534010     2 17671
17675 17674  O     30.244665    6.655266   13.129542     1 17675 17676
17676 17675  H     30.765171    7.376067   13.484157     2 17674
17677 17676  H     30.820840    6.234420   12.491464     2 17674
17678 17677  O     21.824464    0.605849    4.199997     1 17678 17679
17679 17678  H     21.422584    1.416994    4.511075     2 17677
17680 17679  H     21.719468   -0.008108    4.926815     2 17677
17681 17680  O     -0.490411    5.957945   10.445973     1 17681 17682
17682 17681  H     -1.297668    5.663033   10.867394     2 17680
17683 17682  H     -0.641070    6.884938   10.260994     2 17680
17684 17683  O      8.949679   14.651450   30.730647     1 17684 17685
17685 17684  H      8.603378   13.784396   30.519641     2 17683
17686 17685  H      8.922442   14.694654   31.686484     2 17683
17687 17686  O     18.959049    4.961552   -2.676052     1 17687 17688
17688 17687  H     18.561918    5.036144   -1.808322     2 17686
17689 17688  H     18.529028    5.640531   -3.195957     2 17686
17690 17689  O     14.684026    2.978239    9.042060     1 17690 17691
17691 17690  H     14.823788    3.910803    8.877679     2 17689
17692 17691  H     13.784123    2.923460    9.363628     2 17689
17693 17692  O      8.185819   23.724338    2.631882     1 17693 17694
17694 17693  H      8.869218   24.394175    2.609188     2 17692
17695 17694  H      7.366109   24.215974    2.580877     2 17692
17696 17695  O    -31.013812  -13.858534   -8.862822     1 17696 17697
17697 17696  H    -31.745308  -14.144652   -9.409887     2 17695
17698 17697  H    -30.310663  -13.666857   -9.483364     2 17695
17699 17698  O     27.419878    2.365454   19.979183     1 17699 17700
17700 17699  H     26.698426    2.788674   19.513756     2 17698
17701 17700  H     27.551388    2.904566   20.759115     2 17698
17702 17701  O     13.096481    8.729710    0.458324     1 17702 17703
17703 17702  H     13.493291    7.910549    0.162100     2 17701
17704 17703  H     13.386215    8.822288    1.365911     2 17701
17705 17704  O     24.606594    4.999535    3.175722     1 17705 17706
17706 17705  H     23.846230    5.579237    3.220722     2 17704
17707 17706  H     24.665328    4.751937    2.252967     2 17704
17708 17707  O     34.537693   -1.676386  -12.778777     1 17708 17709
17709 17708  H     34.612477   -2.374367  -13.429516     2 17707
17710 17709  H     34.703247   -2.110008  -11.941642     2 17707
17711 17710  O     13.430401   -8.635411    6.154479     1 17711 17712
17712 17711  H     12.589667   -8.714414    6.605207     2 17710
17713 17712  H     13.733580   -7.752270    6.365133     2 17710
17714 17713  O      9.096441    8.869653    9.754682     1 17714 17715
17715 17714  H      8.577973    8.426835   10.426496     2 17713
17716 17715  H      9.484314    9.619272   10.206188     2 17713
17717 17716  O     17.542771    8.114011   -0.887644     1 17717 17718
17718 17717  H     16.626164    8.385789   -0.934556     2 17716
17719 17718  H     17.507410    7.195787   -0.619602     2 17716
17720 17719  O     13.307913    8.329497   14.392554     1 17720 17721
17721 17720  H     13.070905    7.583300   13.841875     2 17719
17722 17721  H     13.043180    8.070133   15.275096     2 17719
17723 17722  O      7.617550    9.502590    2.705507     1 17723 17724
17724 17723  H      8.211215   10.108481    3.149003     2 17722
17725 17724  H      7.493077    9.882138    1.835633     2 17722
17726 17725  O     23.735489    7.500538   22.488484     1 17726 17727
17727 17726  H     23.405673    6.789078   23.037371     2 17725
17728 17727  H     23.835324    8.239839   23.088234     2 17725
17729 17728  O     19.657046   28.315173   -2.366755     1 17729 17730
17730 17729  H     20.019349   27.892151   -3.145228     2 17728
17731 17730  H     20.066564   27.857643   -1.632457     2 17728
17732 17731  O     15.428921   -1.073597    3.035015     1 17732 17733
17733 17732  H     14.528893   -1.257607    3.303942     2 17731
17734 17733  H     15.959428   -1.306441    3.796971     2 17731
17735 17734  O     21.332716    8.830851   11.936176     1 17735 17736
17736 17735  H     22.138120    8.449804   12.285973     2 17734
17737 17736  H     21.117405    8.284626   11.180192     2 17734
17738 17737  O     26.036691   -5.510558   13.504098     1 17738 17739
17739 17738  H     26.702574   -5.905576   12.941255     2 17737
17740 17739  H     25.237102   -5.999390   13.309338     2 17737
17741 17740  O     20.584277   15.603039    4.167436     1 17741 17742
17742 17741  H     20.375534   16.390671    3.665148     2 17740
17743 17742  H     20.870234   15.930905    5.020059     2 17740
17744 17743  O     -6.099498    5.463162    9.562018     1 17744 17745
17745 17744  H     -5.518012    4.703994    9.519951     2 17743
17746 17745  H     -6.980654    5.094173    9.501653     2 17743
17747 17746  O     16.315471   -3.665750   10.976767     1 17747 17748
17748 17747  H     16.674798   -2.795702   11.150354     2 17746
17749 17748  H     17.000437   -4.269842   11.263341     2 17746
17750 17749  O     -1.568888   14.348844  -35.561743     1 17750 17751
17751 17750  H     -2.112281   15.056288  -35.214641     2 17749
17752 17751  H     -0.679778   14.703328  -35.554130     2 17749
17753 17752  O     23.590892    3.919442   19.894321     1 17753 17754
17754 17753  H     24.442200    3.932889   19.456915     2 17752
17755 17754  H     22.959733    3.786802   19.187018     2 17752
17756 17755  O     15.415532    6.862954   16.486625     1 17756 17757
17757 17756  H     14.704295    7.365696   16.089606     2 17755
17758 17757  H     15.366570    6.004547   16.065944     2 17755
17759 17758  O     -7.970555  -34.710361   -6.600778     1 17759 17760
17760 17759  H     -8.867735  -34.405657   -6.736627     2 17758
17761 17760  H     -8.012109  -35.228169   -5.796800     2 17758
17762 17761  O     32.339631    9.069805    5.806378     1 17762 17763
17763 17762  H     31.497659    9.052706    5.351382     2 17761
17764 17763  H     32.989976    8.966558    5.111667     2 17761
17765 17764  O     22.115338    4.796694   23.890143     1 17765 17766
17766 17765  H     21.168541    4.717173   24.006259     2 17764
17767 17766  H     22.484844    4.500828   24.722105     2 17764
17768 17767  O     17.258975   -0.585425    5.255027     1 17768 17769
17769 17768  H     16.802098   -0.215998    6.010685     2 17767
17770 17769  H     17.558726    0.176787    4.759634     2 17767
17771 17770  O     22.930965   19.969497   -3.508435     1 17771 17772
17772 17771  H     23.284723   19.852467   -2.626737     2 17770
17773 17772  H     22.064793   20.352860   -3.370560     2 17770
17774 17773  O     -8.659534  -26.987140  -14.628927     1 17774 17775
17775 17774  H     -8.546846  -26.141150  -14.195529     2 17773
17776 17775  H     -7.964202  -27.014583  -15.286187     2 17773
17777 17776  O     32.924822    1.891232    3.375333     1 17777 17778
17778 17777  H     33.628847    2.457932    3.690661     2 17776
17779 17778  H     32.165913    2.469862    3.301335     2 17776
17780 17779  O     12.963646    8.747543   24.179558     1 17780 17781
17781 17780  H     12.742151    7.913466   24.593668     2 17779
17782 17781  H     12.956066    9.381163   24.896984     2 17779
17783 17782  O     24.731667    4.392677    0.224245     1 17783 17784
17784 17783  H     24.690936    3.563645   -0.252492     2 17782
17785 17784  H     23.948628    4.867981   -0.053542     2 17782
17786 17785  O     28.418794    9.203269   11.036708     1 17786 17787
17787 17786  H     28.458006    9.703208   10.221383     2 17785
17788 17787  H     27.961118    9.778906   11.649412     2 17785
17789 17788  O      5.726919   15.653863   25.780640     1 17789 17790
17790 17789  H      4.923022   16.121794   26.006518     2 17788
17791 17790  H      6.350375   16.343718   25.553407     2 17788
17792 17791  O     16.832095    1.563006   16.341913     1 17792 17793
17793 17792  H     16.283498    0.881738   15.953138     2 17791
17794 17793  H     16.518059    1.638891   17.242943     2 17791
17795 17794  O     27.786201    8.187509    4.670459     1 17795 17796
17796 17795  H     27.393117    7.831443    5.467287     2 17794
17797 17796  H     27.658242    7.503368    4.013337     2 17794
17798 17797  O    -26.457443  -22.037606   -0.374731     1 17798 17799
17799 17798  H    -26.141626  -22.411479    0.447893     2 17797
17800 17799  H    -26.083152  -21.156911   -0.397409     2 17797
17801 17800  O     18.936631    1.717095    4.914751     1 17801 17802
17802 17801  H     19.348534    2.279556    4.258852     2 17800
17803 17802  H     18.527475    2.325686    5.529926     2 17800
17804 17803  O      2.920334    8.874831   21.261747     1 17804 17805
17805 17804  H      3.232171    9.769232   21.123769     2 17803
17806 17805  H      1.967211    8.955740   21.296981     2 17803
17807 17806  O     30.108122    4.871700    5.881641     1 17807 17808
17808 17807  H     29.905438    5.595841    6.473900     2 17806
17809 17808  H     29.643085    4.121461    6.251930     2 17806
17810 17809  O      6.761459    7.643507  -34.001829     1 17810 17811
17811 17810  H      5.805733    7.630377  -34.053261     2 17809
17812 17811  H      6.995372    8.564489  -34.117186     2 17809
17813 17812  O     22.672246    6.686424   19.973806     1 17813 17814
17814 17813  H     23.064775    7.004873   20.786667     2 17812
17815 17814  H     22.427642    5.780786   20.164118     2 17812
17816 17815  O     -9.730987  -29.167996  -13.811552     1 17816 17817
17817 17816  H     -9.424059  -28.332234  -14.163020     2 17815
17818 17817  H    -10.682175  -29.136601  -13.913955     2 17815
17819 17818  O     -0.778916   18.144743  -31.698152     1 17819 17820
17820 17819  H     -1.508395   18.750898  -31.827259     2 17818
17821 17820  H     -0.353887   18.094906  -32.554363     2 17818
17822 17821  O     25.799712   -0.608820   13.873519     1 17822 17823
17823 17822  H     26.159496   -0.054609   13.180960     2 17821
17824 17823  H     25.675609   -1.462106   13.457909     2 17821
17825 17824  O    -23.187432  -25.547097   -4.697634     1 17825 17826
17826 17825  H    -23.760242  -24.780283   -4.686845     2 17824
17827 17826  H    -22.495492  -25.338622   -4.069950     2 17824
17828 17827  O      3.312650    5.214991   17.462417     1 17828 17829
17829 17828  H      3.113067    6.057744   17.054783     2 17827
17830 17829  H      4.237752    5.276595   17.700370     2 17827
17831 17830  O     31.461956  -19.712283    0.831085     1 17831 17832
17832 17831  H     31.945305  -20.023768    0.065851     2 17830
17833 17832  H     31.138491  -18.848455    0.575346     2 17830
17834 17833  O     24.771677   11.292133   13.129818     1 17834 17835
17835 17834  H     23.896952   11.544762   12.834408     2 17833
17836 17835  H     24.916259   11.809702   13.921935     2 17833
17837 17836  O     25.257610   14.108491    7.345196     1 17837 17838
17838 17837  H     26.023532   13.864350    7.864802     2 17836
17839 17838  H     25.353532   15.050387    7.204264     2 17836
17840 17839  O     34.129700  -16.554658   -2.789484     1 17840 17841
17841 17840  H     34.812016  -17.171980   -3.053282     2 17839
17842 17841  H     33.354885  -17.098901   -2.649149     2 17839
17843 17842  O    -12.081919   34.996254    0.646140     1 17843 17844
17844 17843  H    -11.363604   35.217334    0.053368     2 17842
17845 17844  H    -12.093595   35.708740    1.285248     2 17842
17846 17845  O    -16.131135   35.940205   -0.791500     1 17846 17847
17847 17846  H    -15.948446   35.966801    0.147728     2 17845
17848 17847  H    -15.269176   35.987291   -1.205072     2 17845
17849 17848  O      1.907971   16.044429   19.482194     1 17849 17850
17850 17849  H      2.006392   15.297470   18.891773     2 17848
17851 17850  H      2.756267   16.486884   19.452910     2 17848
17852 17851  O    -17.090288   -2.611368  -33.381205     1 17852 17853
17853 17852  H    -17.068397   -3.049515  -32.530453     2 17851
17854 17853  H    -16.433925   -1.918182  -33.311112     2 17851
17855 17854  O      3.968430   35.296177    4.357783     1 17855 17856
17856 17855  H      3.685726   34.771003    3.609115     2 17854
17857 17856  H      4.767419   34.867073    4.663917     2 17854
17858 17857  O      4.455426   -3.123435   27.270479     1 17858 17859
17859 17858  H      4.342419   -2.497221   27.985543     2 17857
17860 17859  H      5.358096   -3.429166   27.359626     2 17857
17861 17860  O      8.348231   12.045311   28.217840     1 17861 17862
17862 17861  H      9.272609   12.284758   28.151339     2 17860
17863 17862  H      7.875953   12.842137   27.976480     2 17860
17864 17863  O     -2.391328  -22.930154  -29.074034     1 17864 17865
17865 17864  H     -2.340306  -23.128542  -28.139010     2 17863
17866 17865  H     -2.242315  -23.771103  -29.506273     2 17863
17867 17866  O      8.517289   16.370752   18.524780     1 17867 17868
17868 17867  H      8.120451   16.925933   19.195992     2 17866
17869 17868  H      8.045846   15.540313   18.590692     2 17866
17870 17869  O     18.911123   17.188613   18.071866     1 17870 17871
17871 17870  H     19.266781   16.708159   17.324268     2 17869
17872 17871  H     19.125271   18.104169   17.892621     2 17869
17873 17872  O     -8.033238   -7.066671  -34.929945     1 17873 17874
17874 17873  H     -7.347666   -7.401732  -34.352055     2 17872
17875 17874  H     -8.093808   -7.715028  -35.631513     2 17872
17876 17875  O     17.663287    0.111241   10.132505     1 17876 17877
17877 17876  H     16.880279    0.091230   10.682714     2 17875
17878 17877  H     18.392172    0.125317   10.752796     2 17875
17879 17878  O     -5.974857    9.752662   19.182136     1 17879 17880
17880 17879  H     -6.708145   10.264020   18.840034     2 17878
17881 17880  H     -5.596844   10.303899   19.867318     2 17878
17882 17881  O      8.033047   15.631855    9.865837     1 17882 17883
17883 17882  H      7.347605   16.299944    9.873434     2 17881
17884 17883  H      8.843379   16.121015    9.723304     2 17881
17885 17884  O    -35.485344   14.749119    4.268257     1 17885 17886
17886 17885  H    -35.117034   14.650810    5.146274     2 17884
17887 17886  H    -34.802730   14.420083    3.683444     2 17884
17888 17887  O     -0.418850   25.639982   11.180190     1 17888 17889
17889 17888  H     -0.612112   26.414204   11.708832     2 17887
17890 17889  H      0.222540   25.151238   11.695922     2 17887
17891 17890  O     16.085303   14.092593    0.293566     1 17891 17892
17892 17891  H     16.789742   13.445381    0.326949     2 17890
17893 17892  H     15.282865   13.578864    0.385255     2 17890
17894 17893  O     11.879217   23.883952    3.802839     1 17894 17895
17895 17894  H     11.925229   23.334635    4.585377     2 17893
17896 17895  H     11.435862   23.338917    3.152758     2 17893
17897 17896  O     27.795090   15.276948    5.180080     1 17897 17898
17898 17897  H     27.988523   16.037763    5.727780     2 17896
17899 17898  H     27.503124   15.648499    4.347650     2 17896
17900 17899  O      4.559567   13.210636    9.932501     1 17900 17901
17901 17900  H      5.169774   13.430765   10.636363     2 17899
17902 17901  H      4.411880   14.038497    9.475263     2 17899
17903 17902  O     24.426744    9.931328   19.434401     1 17903 17904
17904 17903  H     25.175319    9.334845   19.443072     2 17902
17905 17904  H     24.418649   10.293405   18.548361     2 17902
17906 17905  O      1.811559    3.086236   16.106051     1 17906 17907
17907 17906  H      1.359746    2.528142   16.739003     2 17905
17908 17907  H      2.368332    3.652807   16.640123     2 17905
17909 17908  O     20.987304    3.891725   13.209532     1 17909 17910
17910 17909  H     20.816027    4.665745   13.745993     2 17908
17911 17910  H     20.155820    3.417624   13.199901     2 17908
17912 17911  O     -1.549080   20.617234    5.920887     1 17912 17913
17913 17912  H     -2.462763   20.619037    6.206216     2 17911
17914 17913  H     -1.064250   20.971996    6.666082     2 17911
17915 17914  O     25.922665   13.091099   11.369404     1 17915 17916
17916 17915  H     25.537114   12.702388   12.154571     2 17914
17917 17916  H     26.063138   14.009326   11.600399     2 17914
17918 17917  O     19.167809   -0.643551   20.841024     1 17918 17919
17919 17918  H     19.251122   -0.874574   19.915865     2 17917
17920 17919  H     19.833469   -1.172073   21.281245     2 17917
17921 17920  O     23.383555   16.701365    3.752593     1 17921 17922
17922 17921  H     22.865962   16.209668    4.390217     2 17920
17923 17922  H     23.924004   16.039750    3.320837     2 17920
17924 17923  O     33.046044    2.184965    6.820609     1 17924 17925
17925 17924  H     32.891306    3.126789    6.748111     2 17923
17926 17925  H     33.961977    2.112200    7.088945     2 17923
17927 17926  O     28.509943   13.136869    6.473672     1 17927 17928
17928 17927  H     28.382435   12.329352    5.975786     2 17926
17929 17928  H     28.248675   13.833737    5.871720     2 17926
17930 17929  O      3.034856   -3.573313   24.593679     1 17930 17931
17931 17930  H      2.995236   -2.639440   24.387418     2 17929
17932 17931  H      3.257487   -3.604349   25.524111     2 17929
17933 17932  O     21.685239    9.341311   20.463719     1 17933 17934
17934 17933  H     22.538944    9.337532   20.030814     2 17932
17935 17934  H     21.636779    8.493902   20.906190     2 17932
17936 17935  O     14.969201    5.252532    4.293568     1 17936 17937
17937 17936  H     15.824030    5.455549    4.673414     2 17935
17938 17937  H     14.464785    4.886048    5.019850     2 17935
17939 17938  O     17.404669   21.959656    2.628010     1 17939 17940
17940 17939  H     17.331133   22.645650    1.964507     2 17938
17941 17940  H     16.503675   21.673535    2.778264     2 17938
17942 17941  O      4.827429   17.559551   31.983520     1 17942 17943
17943 17942  H      4.068821   17.426826   32.551964     2 17941
17944 17943  H      4.920236   16.732751   31.510212     2 17941
17945 17944  O     14.288136   16.644836   21.645802     1 17945 17946
17946 17945  H     14.942955   17.330681   21.515184     2 17944
17947 17946  H     14.253017   16.524147   22.594713     2 17944
17948 17947  O     31.112676    3.914559    2.815588     1 17948 17949
17949 17948  H     30.969650    3.926676    1.869211     2 17947
17950 17949  H     30.784576    4.761127    3.118745     2 17947
17951 17950  O     15.135417   10.269333   12.726258     1 17951 17952
17952 17951  H     14.380892    9.852536   12.310080     2 17950
17953 17952  H     14.921197   10.276776   13.659149     2 17950
17954 17953  O     24.659119   -0.819239   16.498899     1 17954 17955
17955 17954  H     25.317175   -0.765208   15.805881     2 17953
17956 17955  H     25.156740   -0.720433   17.310591     2 17953
17957 17956  O      7.822071   19.297653   11.645368     1 17957 17958
17958 17957  H      6.978759   19.668946   11.386145     2 17956
17959 17958  H      7.605648   18.435776   12.001122     2 17956
17960 17959  O      5.573376  -10.208250   -0.967175     1 17960 17961
17961 17960  H      5.568723  -10.945940   -0.357239     2 17959
17962 17961  H      5.360824   -9.447954   -0.425876     2 17959
17963 17962  O      3.089759    7.379485   32.583757     1 17963 17964
17964 17963  H      3.137729    6.513311   32.179191     2 17962
17965 17964  H      3.123675    7.990393   31.847637     2 17962
17966 17965  O     32.451437   -1.316100    8.579356     1 17966 17967
17967 17966  H     31.892766   -2.052585    8.330947     2 17965
17968 17967  H     33.235315   -1.723212    8.948176     2 17965
17969 17968  O     18.084446   10.393339   14.871525     1 17969 17970
17970 17969  H     17.451107   10.734020   15.503228     2 17968
17971 17970  H     18.653259    9.821253   15.386696     2 17968
17972 17971  O     20.314712   20.534440    0.430393     1 17972 17973
17973 17972  H     20.157447   21.335990    0.929408     2 17971
17974 17973  H     19.742945   19.882914    0.836384     2 17971
17975 17974  O     22.171101    3.692796   10.183895     1 17975 17976
17976 17975  H     21.991694    3.782993   11.119795     2 17974
17977 17976  H     21.386045    4.033486    9.755121     2 17974
17978 17977  O     12.968557  -33.495418    0.244634     1 17978 17979
17979 17978  H     13.083920  -32.633611    0.644900     2 17977
17980 17979  H     13.171533  -33.359303   -0.680841     2 17977
17981 17980  O      5.814229    6.013278   22.501875     1 17981 17982
17982 17981  H      5.273605    6.363815   23.209746     2 17980
17983 17982  H      6.271155    6.776491   22.148385     2 17980
17984 17983  O    -33.372929   -6.580867  -14.607274     1 17984 17985
17985 17984  H    -33.730164   -5.743958  -14.904255     2 17983
17986 17985  H    -32.518326   -6.359312  -14.237409     2 17983
17987 17986  O     20.543545    3.827193    3.870280     1 17987 17988
17988 17987  H     20.894812    3.589812    3.012088     2 17986
17989 17988  H     21.206560    4.403907    4.249811     2 17986
17990 17989  O     17.792462    6.401960   17.634174     1 17990 17991
17991 17990  H     17.099605    6.390899   16.973828     2 17989
17992 17991  H     18.367748    7.118613   17.366433     2 17989
17993 17992  O     26.154201   19.786739    1.830226     1 17993 17994
17994 17993  H     26.317439   20.704169    2.049103     2 17992
17995 17994  H     26.795324   19.298940    2.347183     2 17992
17996 17995  O     10.219699    6.439805   24.375181     1 17996 17997
17997 17996  H      9.353656    6.097682   24.596890     2 17995
17998 17997  H     10.147270    7.384193   24.513443     2 17995
17999 17998  O     16.176641   24.422438    6.224331     1 17999 18000
18000 17999  H     16.900139   24.617393    5.628701     2 17998
18001 18000  H     15.390958   24.512027    5.684973     2 17998
18002 18001  O      7.753453   -1.378140   24.878397     1 18002 18003
18003 18002  H      7.131596   -0.933227   25.454224     2 18001
18004 18003  H      8.613608   -1.104297   25.196794     2 18001
18005 18004  O    -32.584896    4.543232    8.763990     1 18005 18006
18006 18005  H    -32.758222    5.452299    9.008503     2 18004
18007 18006  H    -33.190125    4.030929    9.300157     2 18004
18008 18007  O     26.245242    0.914685    8.646787     1 18008 18009
18009 18008  H     25.921687    0.549036    7.823474     2 18007
18010 18009  H     25.985775    1.835621    8.618764     2 18007
18011 18010  O     -2.084937   10.759531   35.440587     1 18011 18012
18012 18011  H     -1.277259   10.693932   34.931093     2 18010
18013 18012  H     -1.890540   10.301943   36.258544     2 18010
18014 18013  O     27.303732    5.814021    3.039674     1 18014 18015
18015 18014  H     26.538766    5.384985    3.423062     2 18013
18016 18015  H     28.018864    5.191388    3.170619     2 18013
18017 18016  O     21.947679   13.790150   18.083835     1 18017 18018
18018 18017  H     21.353258   14.475756   18.388531     2 18016
18019 18018  H     22.530744   13.630764   18.826036     2 18016
18020 18019  O     23.357988    2.100284   -1.096079     1 18020 18021
18021 18020  H     23.771410    1.245040   -1.213860     2 18019
18022 18021  H     22.425825    1.938257   -1.241171     2 18019
18023 18022  O      5.505428   20.177834   10.920010     1 18023 18024
18024 18023  H      6.013239   20.885116   10.522378     2 18022
18025 18024  H      5.110785   20.573339   11.697225     2 18022
18026 18025  O     33.330918   16.672201    1.877813     1 18026 18027
18027 18026  H     32.561333   16.270215    2.280774     2 18025
18028 18027  H     33.110159   16.734741    0.948520     2 18025
18029 18028  O     26.893060    2.399024   -3.716973     1 18029 18030
18030 18029  H     26.975359    1.787891   -2.984870     2 18028
18031 18030  H     26.773078    3.253975   -3.303579     2 18028
18032 18031  O      1.330177   -2.220508   35.293777     1 18032 18033
18033 18032  H      1.811500   -1.644099   35.887336     2 18031
18034 18033  H      0.976954   -2.906901   35.859756     2 18031
18035 18034  O     32.758452    3.044138    9.909442     1 18035 18036
18036 18035  H     32.371419    2.481673   10.580313     2 18034
18037 18036  H     32.268579    2.839609    9.112934     2 18034
18038 18037  O     23.461308    2.910001    4.428491     1 18038 18039
18039 18038  H     23.992113    3.442869    3.836435     2 18037
18040 18039  H     23.319940    2.091389    3.952969     2 18037
18041 18040  O     18.155394   -3.646542   14.793923     1 18041 18042
18042 18041  H     17.974098   -4.352710   14.173689     2 18040
18043 18042  H     17.309078   -3.461563   15.201065     2 18040
18044 18043  O     17.916247   -1.226019  -10.573376     1 18044 18045
18045 18044  H     18.194277   -0.586076   -9.918088     2 18043
18046 18045  H     17.130480   -1.625577  -10.200341     2 18043
18047 18046  O     28.653681   10.528339    1.968247     1 18047 18048
18048 18047  H     28.587455    9.702138    1.489460     2 18046
18049 18048  H     28.545790   11.203329    1.298188     2 18046
18050 18049  O     17.451620   34.143440    1.052881     1 18050 18051
18051 18050  H     18.155166   33.967716    1.677682     2 18049
18052 18051  H     17.501343   33.421604    0.426215     2 18049
18053 18052  O      3.610300   28.302182   14.334553     1 18053 18054
18054 18053  H      4.435948   28.615145   13.964970     2 18052
18055 18054  H      3.247333   27.728673   13.659591     2 18052
18056 18055  O     18.680651   -2.915833    4.929586     1 18056 18057
18057 18056  H     19.155906   -3.242841    5.693412     2 18055
18058 18057  H     18.376703   -2.046388    5.190185     2 18055
18059 18058  O     21.430665    5.389404   -3.262574     1 18059 18060
18060 18059  H     20.614895    5.043447   -2.900545     2 18058
18061 18060  H     21.175723    6.206815   -3.690447     2 18058
18062 18061  O      2.712941    6.771648    0.538262     1 18062 18063
18063 18062  H      2.652384    7.339658   -0.229808     2 18061
18064 18063  H      2.857609    5.896429    0.178689     2 18061
18065 18064  O      8.407451   -0.372675   11.882991     1 18065 18066
18066 18065  H      8.359338   -0.269650   10.932568     2 18064
18067 18066  H      7.787469    0.270990   12.225846     2 18064
18068 18067  O     17.503520    9.450759   25.851581     1 18068 18069
18069 18068  H     17.048907   10.225680   26.181817     2 18067
18070 18069  H     16.860136    9.015097   25.292577     2 18067
18071 18070  O     26.160888    9.773856   -1.235308     1 18071 18072
18072 18071  H     25.741776   10.333654   -0.581700     2 18070
18073 18072  H     25.892271   10.144119   -2.076131     2 18070
18074 18073  O     24.957753    5.523380   15.273810     1 18074 18075
18075 18074  H     25.909297    5.439147   15.334646     2 18073
18076 18075  H     24.658570    4.661531   14.984090     2 18073
18077 18076  O      7.283842   27.846474    6.882542     1 18077 18078
18078 18077  H      7.364724   28.726876    6.515689     2 18076
18079 18078  H      7.652292   27.918597    7.763039     2 18076
18080 18079  O      0.151817    8.702996   21.648227     1 18080 18081
18081 18080  H      0.140355    8.599124   22.599705     2 18079
18082 18081  H     -0.146918    9.600416   21.501168     2 18079
18083 18082  O      5.052811   20.313091    1.125060     1 18083 18084
18084 18083  H      5.062275   20.909454    0.376399     2 18082
18085 18084  H      4.859751   19.455476    0.746302     2 18082
18086 18085  O     17.127475   12.216782   12.387174     1 18086 18087
18087 18086  H     17.847440   11.821586   11.895542     2 18085
18088 18087  H     16.481181   11.515763   12.471477     2 18085
18089 18088  O     -0.027557  -28.288444  -25.813952     1 18089 18090
18090 18089  H      0.248315  -29.204294  -25.777270     2 18088
18091 18090  H     -0.490555  -28.144033  -24.988718     2 18088
18092 18091  O      0.150120    2.567139   31.754855     1 18092 18093
18093 18092  H     -0.380513    3.324921   31.509034     2 18091
18094 18093  H     -0.470753    1.839272   31.785798     2 18091
18095 18094  O     22.152065    6.053486    8.236210     1 18095 18096
18096 18095  H     22.413448    6.721697    7.602645     2 18094
18097 18096  H     22.483821    5.233380    7.870704     2 18094
18098 18097  O     21.109668    3.122738    1.284314     1 18098 18099
18099 18098  H     20.262454    3.127971    0.838856     2 18097
18100 18099  H     21.740977    3.351052    0.601999     2 18097
18101 18100  O      6.145618   13.064208    4.331633     1 18101 18102
18102 18101  H      6.150056   13.124190    5.286942     2 18100
18103 18102  H      5.251774   12.801619    4.111811     2 18100
18104 18103  O     19.266601   -2.895103    2.197670     1 18104 18105
18105 18104  H     19.492840   -2.945778    3.126368     2 18103
18106 18105  H     19.861705   -2.235472    1.841339     2 18103
18107 18106  O     15.267796    2.724018   31.926327     1 18107 18108
18108 18107  H     15.531540    2.119756   31.232398     2 18106
18109 18108  H     14.344779    2.905085   31.748879     2 18106
18110 18109  O     19.824692   22.010849    4.275642     1 18110 18111
18111 18110  H     19.115506   22.064061    3.634975     2 18109
18112 18111  H     19.452149   21.516121    5.005496     2 18109
18113 18112  O    -10.731580  -34.044171   -6.765113     1 18113 18114
18114 18113  H    -10.696160  -34.976316   -6.979782     2 18112
18115 18114  H    -11.638808  -33.893314   -6.499765     2 18112
18116 18115  O      5.711843    2.373913   24.811604     1 18116 18117
18117 18116  H      6.386398    2.406717   24.133276     2 18115
18118 18117  H      4.974807    2.859201   24.440788     2 18115
18119 18118  O      8.873168   22.323142    4.911608     1 18119 18120
18120 18119  H      8.053505   21.880686    5.132099     2 18118
18121 18120  H      8.626739   22.968800    4.249315     2 18118
18122 18121  O     22.261640    9.036783    3.153658     1 18122 18123
18123 18122  H     22.228380    9.680026    3.861729     2 18121
18124 18123  H     21.391262    8.638459    3.150206     2 18121
18125 18124  O      4.173618   10.537439   10.652750     1 18125 18126
18126 18125  H      4.211217   11.473634   10.456903     2 18124
18127 18126  H      4.748975   10.133110   10.003355     2 18124
18128 18127  O     -7.709053  -23.868791  -22.155203     1 18128 18129
18129 18128  H     -7.946287  -23.711858  -23.069164     2 18127
18130 18129  H     -6.834977  -24.256665  -22.197344     2 18127
18131 18130  O      7.516325   10.324002  -34.518501     1 18131 18132
18132 18131  H      7.664395   10.423738  -35.458905     2 18130
18133 18132  H      7.675825   11.195705  -34.156664     2 18130
18134 18133  O      6.474080   14.020246   27.918587     1 18134 18135
18135 18134  H      6.202513   14.655487   28.581121     2 18133
18136 18135  H      6.294276   14.452521   27.083697     2 18133
18137 18136  O     26.669019    6.315615    0.395122     1 18137 18138
18138 18137  H     26.884336    6.311736    1.327782     2 18136
18139 18138  H     26.100401    5.554737    0.276929     2 18136
18140 18139  O    -20.805700  -21.298931   -8.816902     1 18140 18141
18141 18140  H    -20.404057  -22.000482   -8.304321     2 18139
18142 18141  H    -20.130898  -20.621920   -8.867210     2 18139
18143 18142  O     23.446939   13.299121    9.432184     1 18143 18144
18144 18143  H     23.454360   13.405052    8.480893     2 18142
18145 18144  H     24.321903   12.974035    9.644288     2 18142
18146 18145  O     19.251841   -2.244784   17.034856     1 18146 18147
18147 18146  H     19.905845   -1.562867   16.881556     2 18145
18148 18147  H     19.290084   -2.794311   16.252047     2 18145
18149 18148  O     23.267443   -0.640309   20.737333     1 18149 18150
18150 18149  H     23.533355   -0.363121   21.614083     2 18148
18151 18150  H     22.322608   -0.488742   20.713968     2 18148
18152 18151  O     20.266173    6.914836    9.983065     1 18152 18153
18153 18152  H     19.749108    6.109399    9.995165     2 18151
18154 18153  H     21.015158    6.710804    9.423043     2 18151
18155 18154  O      8.379909    0.095914    9.285985     1 18155 18156
18156 18155  H      7.802930   -0.261270    8.610894     2 18154
18157 18156  H      8.892326    0.766084    8.833731     2 18154
18158 18157  O     21.703040   -0.080859   28.102403     1 18158 18159
18159 18158  H     22.494801   -0.486127   28.456101     2 18157
18160 18159  H     22.006192    0.413716   27.341005     2 18157
18161 18160  O     12.631377   -1.047070   22.599982     1 18161 18162
18162 18161  H     13.165036   -0.957373   23.389535     2 18160
18163 18162  H     13.265450   -1.182895   21.895898     2 18160
18164 18163  O     21.634422    1.046299    8.648522     1 18164 18165
18165 18164  H     21.274600    0.553090    9.385749     2 18163
18166 18165  H     21.695392    1.946274    8.968772     2 18163
18167 18166  O    -11.444336  -28.519246    6.746659     1 18167 18168
18168 18167  H    -11.710933  -27.602391    6.814006     2 18166
18169 18168  H    -11.921340  -28.852672    5.986708     2 18166
18170 18169  O     16.876647   -2.866886    1.114983     1 18170 18171
18171 18170  H     16.194936   -2.235556    1.345036     2 18169
18172 18171  H     17.500594   -2.820989    1.839424     2 18169
18173 18172  O     34.172092   11.986799    3.914241     1 18173 18174
18174 18173  H     34.419241   12.343730    4.767323     2 18172
18175 18174  H     33.240055   11.785929    3.999030     2 18172
18176 18175  O     23.153625    2.476701   14.995064     1 18176 18177
18177 18176  H     22.255390    2.374454   14.680500     2 18175
18178 18177  H     23.098210    2.313490   15.936618     2 18175
18179 18178  O     17.437826   11.592712    3.392517     1 18179 18180
18180 18179  H     16.859047   12.248512    3.781325     2 18178
18181 18180  H     18.302454   12.003368    3.396129     2 18178
18182 18181  O     28.537721   14.300112   10.805522     1 18182 18183
18183 18182  H     29.139080   14.697440   11.435387     2 18181
18184 18183  H     27.682154   14.669010   11.024955     2 18181
18185 18184  O      2.616430    1.698681   29.113195     1 18185 18186
18186 18185  H      2.335390    2.177586   29.892874     2 18184
18187 18186  H      1.838778    1.214451   28.835687     2 18184
18188 18187  O      3.388958   12.259284    7.037122     1 18188 18189
18189 18188  H      3.259380   12.370599    7.978955     2 18187
18190 18189  H      2.527742   12.006328    6.704629     2 18187
18191 18190  O     19.415366   10.790701   18.855594     1 18191 18192
18192 18191  H     19.928637   10.351710   19.533878     2 18190
18193 18192  H     18.819396   11.363294   19.338490     2 18190
18194 18193  O     24.900530   14.288617    4.005314     1 18194 18195
18195 18194  H     25.855409   14.316412    3.944792     2 18193
18196 18195  H     24.725541   13.930626    4.875632     2 18193
18197 18196  O     -1.359182   -1.688339  -35.559205     1 18197 18198
18198 18197  H     -1.250651   -0.796006  -35.888134     2 18196
18199 18198  H     -0.600287   -1.829421  -34.993162     2 18196
18200 18199  O      9.372759   13.068988   23.007034     1 18200 18201
18201 18200  H      9.432081   13.512009   23.853465     2 18199
18202 18201  H     10.190148   13.291988   22.561637     2 18199
18203 18202  O     26.242830   -1.402979   18.551651     1 18203 18204
18204 18203  H     27.097937   -1.668058   18.890410     2 18202
18205 18204  H     25.618393   -1.711812   19.208105     2 18202
18206 18205  O     24.726415    9.182197    9.785680     1 18206 18207
18207 18206  H     25.288800    9.426624   10.520669     2 18205
18208 18207  H     24.103520    8.557675   10.157441     2 18205
18209 18208  O     24.705672   23.138621    1.971276     1 18209 18210
18210 18209  H     25.650551   23.003522    2.043273     2 18208
18211 18210  H     24.532383   23.125360    1.029986     2 18208
18212 18211  O     27.494209    5.343831   16.179896     1 18212 18213
18213 18212  H     28.307989    4.842163   16.131711     2 18211
18214 18213  H     27.726802    6.210931   15.847826     2 18211
18215 18214  O     27.897030    2.641274    2.845128     1 18215 18216
18216 18215  H     28.339620    1.805735    2.696062     2 18214
18217 18216  H     28.583528    3.220972    3.175133     2 18214
18218 18217  O     28.095349    6.058742   19.270588     1 18218 18219
18219 18218  H     28.931571    6.187803   19.718146     2 18217
18220 18219  H     28.331280    5.941255   18.350389     2 18217
18221 18220  O     29.715782    0.358829   23.071655     1 18221 18222
18222 18221  H     29.366251    1.197237   23.373537     2 18220
18223 18222  H     30.140231   -0.016072   23.843357     2 18220
18224 18223  O     14.689459   15.168547   10.528191     1 18224 18225
18225 18224  H     15.214494   14.927796    9.764902     2 18223
18226 18225  H     15.287651   15.076247   11.269729     2 18223
18227 18226  O     24.096598   17.771884    1.148839     1 18227 18228
18228 18227  H     23.621002   17.600296    1.961611     2 18226
18229 18228  H     24.756913   18.421631    1.389762     2 18226
18230 18229  O     -5.109149  -27.256117  -19.335299     1 18230 18231
18231 18230  H     -6.013090  -27.460029  -19.095421     2 18229
18232 18231  H     -4.835467  -26.594932  -18.699559     2 18229
18233 18232  O     -5.764338  -30.726875  -16.022759     1 18233 18234
18234 18233  H     -5.189302  -31.266591  -16.565226     2 18232
18235 18234  H     -5.281828  -30.609677  -15.204419     2 18232
18236 18235  O     -2.741530    6.818467   22.471264     1 18236 18237
18237 18236  H     -2.338685    7.375064   21.804821     2 18235
18238 18237  H     -2.884682    5.981139   22.030106     2 18235
18239 18238  O     15.714617    0.091195    8.411560     1 18239 18240
18240 18239  H     15.446354    0.975659    8.162583     2 18238
18241 18240  H     16.603983    0.196352    8.749500     2 18238
18242 18241  O    -12.522789    0.899644  -34.541846     1 18242 18243
18243 18242  H    -11.666407    1.318821  -34.457384     2 18241
18244 18243  H    -12.893186    0.930615  -33.659759     2 18241
18245 18244  O     18.983716    1.823783    8.348172     1 18245 18246
18246 18245  H     18.757464    1.426513    9.189134     2 18244
18247 18246  H     19.531017    1.169858    7.913345     2 18244
18248 18247  O     21.168382   10.360199    9.313783     1 18248 18249
18249 18248  H     21.409865   10.137749   10.212912     2 18247
18250 18249  H     20.872065   11.269062    9.362737     2 18247
18251 18250  O     22.403920    5.401561   -0.671796     1 18251 18252
18252 18251  H     22.187538    5.225538   -1.587452     2 18250
18253 18252  H     22.491082    6.353612   -0.624537     2 18250
18254 18253  O    -31.188709  -20.685071    0.193541     1 18254 18255
18255 18254  H    -31.344691  -21.087185   -0.660980     2 18253
18256 18255  H    -31.868510  -20.015722    0.271477     2 18253
18257 18256  O    -34.305976    3.199426   10.547940     1 18257 18258
18258 18257  H    -34.927578    2.513808   10.303460     2 18256
18259 18258  H    -33.566617    2.727498   10.931167     2 18256
18260 18259  O     -5.130113    7.981848   -2.440637     1 18260 18261
18261 18260  H     -4.758763    8.090974   -1.565181     2 18259
18262 18261  H     -4.958266    8.814837   -2.879760     2 18259
18263 18262  O     25.709310    2.132347   14.861145     1 18263 18264
18264 18263  H     24.761334    2.210813   14.967991     2 18262
18265 18264  H     25.849722    1.213759   14.631555     2 18262
18266 18265  O     31.290344    2.631678   12.598397     1 18266 18267
18267 18266  H     31.640988    2.957370   13.427376     2 18265
18268 18267  H     30.435357    2.266626   12.826358     2 18265
18269 18268  O    -11.718681  -24.318915  -10.544435     1 18269 18270
18270 18269  H    -10.882948  -24.528461  -10.127454     2 18268
18271 18270  H    -12.045921  -23.561665  -10.058927     2 18268
18272 18271  O     -2.208712  -14.715223  -29.708484     1 18272 18273
18273 18272  H     -1.500091  -14.274827  -30.177675     2 18271
18274 18273  H     -1.805656  -15.507800  -29.354084     2 18271
18275 18274  O     24.267065   24.472096    4.408725     1 18275 18276
18276 18275  H     24.549849   24.039054    3.603282     2 18274
18277 18276  H     23.694264   23.834869    4.835425     2 18274
18278 18277  O      2.670679   11.117227   14.076168     1 18278 18279
18279 18278  H      3.579964   11.396215   14.183862     2 18277
18280 18279  H      2.716679   10.377955   13.469873     2 18277
18281 18280  O      1.534817    0.254475   32.366916     1 18281 18282
18282 18281  H      1.423273    1.117110   31.967355     2 18280
18283 18282  H      0.647616   -0.018105   32.601023     2 18280
18284 18283  O     23.789675    1.103965   -4.793286     1 18284 18285
18285 18284  H     24.002296    1.967891   -4.440220     2 18283
18286 18285  H     24.046692    0.492699   -4.102974     2 18283
18287 18286  O     29.598490    2.173429   18.184406     1 18287 18288
18288 18287  H     28.814489    2.080248   18.725600     2 18286
18289 18288  H     30.065708    2.917208   18.564841     2 18286
18290 18289  O     16.576638   -2.698781   17.771670     1 18290 18291
18291 18290  H     16.390929   -2.809226   18.704164     2 18289
18292 18291  H     17.510101   -2.893472   17.688166     2 18289
18293 18292  O     22.046932   12.102291   13.266198     1 18293 18294
18294 18293  H     21.549185   12.086272   14.083648     2 18292
18295 18294  H     21.626722   11.440983   12.716356     2 18292
18296 18295  O     13.004317    7.308032    9.117294     1 18296 18297
18297 18296  H     12.593715    7.669080    8.331621     2 18295
18298 18297  H     12.273574    6.976895    9.639400     2 18295
18299 18298  O      0.075477   33.394510    3.186178     1 18299 18300
18300 18299  H      0.916784   32.955268    3.310678     2 18298
18301 18300  H      0.301503   34.241399    2.801571     2 18298
18302 18301  O      6.374001    2.902670   17.828624     1 18302 18303
18303 18302  H      7.269149    2.573331   17.748147     2 18301
18304 18303  H      5.855040    2.132765   18.061344     2 18301
18305 18304  O     -8.639617  -24.414509  -18.569822     1 18305 18306
18306 18305  H     -8.516719  -23.489350  -18.782447     2 18304
18307 18306  H     -9.043103  -24.409722  -17.701831     2 18304
18308 18307  O      5.171298    8.704579    8.954075     1 18308 18309
18309 18308  H      5.913402    8.130726    8.763798     2 18307
18310 18309  H      4.421116    8.113516    9.018119     2 18307
18311 18310  O     11.482384    3.870720   14.717885     1 18311 18312
18312 18311  H     11.485177    3.862939   13.760721     2 18310
18313 18312  H     12.397396    4.014470   14.959383     2 18310
18314 18313  O      1.892775   -3.734599   27.816279     1 18314 18315
18315 18314  H      2.113708   -4.643906   28.017726     2 18313
18316 18315  H      2.726636   -3.267602   27.869396     2 18313
18317 18316  O     -0.751963    6.599541   20.231267     1 18317 18318
18318 18317  H     -0.203592    7.312129   20.559504     2 18316
18319 18318  H     -0.131393    5.915798   19.979038     2 18316
18320 18319  O    -14.028616  -30.924228   -3.342383     1 18320 18321
18321 18320  H    -14.195192  -31.820234   -3.049711     2 18319
18322 18321  H    -14.842024  -30.656288   -3.769942     2 18319
18323 18322  O     27.653680   -0.324980   -3.605464     1 18323 18324
18324 18323  H     27.068971    0.180803   -4.169849     2 18322
18325 18324  H     27.184847   -1.144317   -3.446990     2 18322
18326 18325  O     22.764572    6.637588    4.482054     1 18326 18327
18327 18326  H     22.860116    7.173536    5.269368     2 18325
18328 18327  H     22.519651    7.259359    3.796747     2 18325
18329 18328  O     -0.193875    9.576060   24.287700     1 18329 18330
18330 18329  H     -0.882641    9.405691   24.930201     2 18328
18331 18330  H      0.458618   10.088167   24.765436     2 18328
18332 18331  O      9.784644   12.154148   10.758665     1 18332 18333
18333 18332  H      9.615219   12.572571   11.602732     2 18331
18334 18333  H     10.599485   12.552413   10.452640     2 18331
18335 18334  O     35.955160   15.611233    2.053279     1 18335 18336
18336 18335  H     35.096864   15.847931    2.404752     2 18334
18337 18336  H     36.446677   15.296483    2.811946     2 18334
18338 18337  O      4.632134    6.550190    5.090551     1 18338 18339
18339 18338  H      4.066385    7.060939    5.669598     2 18337
18340 18339  H      4.980257    5.854183    5.647880     2 18337
18341 18340  O     19.015257   10.557895   11.846168     1 18341 18342
18342 18341  H     19.907196   10.260388   11.666817     2 18340
18343 18342  H     18.782168   10.133458   12.671852     2 18340
18344 18343  O     34.910101   -0.560664    3.751036     1 18344 18345
18345 18344  H     35.255626    0.186438    4.239586     2 18343
18346 18345  H     34.182959   -0.880910    4.284832     2 18343
18347 18346  O     10.258082    0.847935   19.568989     1 18347 18348
18348 18347  H     11.158451    1.172253   19.588640     2 18346
18349 18348  H     10.077195    0.587091   20.472024     2 18346
18350 18349  O      7.392835   10.315997   24.373327     1 18350 18351
18351 18350  H      6.868263    9.582652   24.694669     2 18349
18352 18351  H      7.661898   10.783318   25.164180     2 18349
18353 18352  O     36.268840    5.062417   10.074222     1 18353 18354
18354 18353  H     36.008822    4.268665   10.541746     2 18352
18355 18354  H     36.932079    4.767126    9.450404     2 18352
18356 18355  O     31.512589   -3.650383   19.021795     1 18356 18357
18357 18356  H     32.264667   -3.421213   18.475817     2 18355
18358 18357  H     31.025523   -4.290515   18.502922     2 18355
18359 18358  O      2.452870    9.989235   17.812724     1 18359 18360
18360 18359  H      2.691605    9.657487   18.678276     2 18358
18361 18360  H      3.114277    9.624126   17.224959     2 18358
18362 18361  O      9.559111    5.690424   14.925186     1 18362 18363
18363 18362  H      9.234799    5.702937   15.825683     2 18361
18364 18363  H     10.274106    5.054115   14.936433     2 18361
18365 18364  O     23.973777    4.689296    6.443147     1 18365 18366
18366 18365  H     24.100108    5.432510    5.853313     2 18364
18367 18366  H     23.647014    3.988236    5.879257     2 18364
18368 18367  O      6.150265   18.908410   25.194868     1 18368 18369
18369 18368  H      5.247641   18.683642   24.969079     2 18367
18370 18369  H      6.434336   19.494384   24.493320     2 18367
18371 18370  O     -0.189973   10.496164   33.497333     1 18371 18372
18372 18371  H      0.517665   10.258135   34.096352     2 18370
18373 18372  H      0.253356   10.719797   32.678994     2 18370
18374 18373  O    -31.177032    7.745597    6.858373     1 18374 18375
18375 18374  H    -30.752048    6.894336    6.753613     2 18373
18376 18375  H    -31.903828    7.729236    6.235693     2 18373
18377 18376  O     19.454541    4.253163   10.117187     1 18377 18378
18378 18377  H     19.195983    3.657148    9.414234     2 18376
18379 18378  H     19.047093    3.888649   10.902902     2 18376
18380 18379  O     14.446693   16.999787    7.574196     1 18380 18381
18381 18380  H     14.815158   17.867088    7.742282     2 18379
18382 18381  H     15.127055   16.390390    7.860510     2 18379
18383 18382  O      5.908886   24.436727   15.314976     1 18383 18384
18384 18383  H      5.995771   23.863686   16.076754     2 18382
18385 18384  H      5.856386   23.838623   14.569492     2 18382
18386 18385  O      6.655874  -32.566181    1.326589     1 18386 18387
18387 18386  H      7.143234  -31.992522    0.735297     2 18385
18388 18387  H      6.723294  -33.434110    0.928611     2 18385
18389 18388  O      7.068188   22.477861    9.710916     1 18389 18390
18390 18389  H      6.728887   23.352654    9.521589     2 18388
18391 18390  H      7.564200   22.238233    8.928113     2 18388
18392 18391  O      6.626588   26.703562   16.729368     1 18392 18393
18393 18392  H      6.369149   25.899302   16.278676     2 18391
18394 18393  H      5.810787   27.045200   17.095406     2 18391
18395 18394  O     24.085866    3.637106   -7.125707     1 18395 18396
18396 18395  H     24.208298    3.561988   -6.179345     2 18394
18397 18396  H     23.583411    2.858396   -7.365251     2 18394
18398 18397  O     19.389791   13.072374    4.357675     1 18398 18399
18399 18398  H     19.752513   13.948536    4.488076     2 18397
18400 18399  H     19.887350   12.515135    4.956132     2 18397
18401 18400  O      6.315627   32.469610    6.970312     1 18401 18402
18402 18401  H      6.081216   33.373198    7.182001     2 18400
18403 18402  H      6.073519   31.969913    7.750002     2 18400
18404 18403  O     19.999040   21.556190    8.948943     1 18404 18405
18405 18404  H     19.096035   21.378797    9.212277     2 18403
18406 18405  H     20.437673   21.819344    9.758005     2 18403
18407 18406  O      0.969956   32.579575   10.303791     1 18407 18408
18408 18407  H      0.217038   33.077744   10.621872     2 18406
18409 18408  H      1.729490   33.102515   10.560451     2 18406
18410 18409  O    -14.763786  -13.622489  -15.146628     1 18410 18411
18411 18410  H    -13.968127  -14.154295  -15.165097     2 18409
18412 18411  H    -14.804880  -13.283068  -14.252572     2 18409
18413 18412  O      0.736565    4.033719   13.776992     1 18413 18414
18414 18413  H      1.035670    3.623954   14.588694     2 18412
18415 18414  H      0.299899    4.836984   14.060400     2 18412
18416 18415  O     10.354585   26.984267    7.680017     1 18416 18417
18417 18416  H     10.073587   27.083931    8.589599     2 18415
18418 18417  H     10.539141   26.049656    7.586887     2 18415
18419 18418  O     33.852541    8.806506    8.436887     1 18419 18420
18420 18419  H     34.032990    7.966338    8.858536     2 18418
18421 18420  H     33.514197    8.573381    7.572360     2 18418
18422 18421  O    -19.205809  -20.885872  -13.747112     1 18422 18423
18423 18422  H    -19.144654  -21.840026  -13.792738     2 18421
18424 18423  H    -19.827728  -20.718845  -13.038910     2 18421
18425 18424  O      9.865030   20.678659   12.431427     1 18425 18426
18426 18425  H     10.300204   20.003213   12.951645     2 18424
18427 18426  H      9.219151   20.201441   11.910528     2 18424
18428 18427  O      3.643393   23.865342    5.345347     1 18428 18429
18429 18428  H      3.366809   24.767437    5.184233     2 18427
18430 18429  H      2.976227   23.511145    5.933280     2 18427
18431 18430  O     17.477465   -5.397720    4.189293     1 18431 18432
18432 18431  H     18.273125   -5.923563    4.270811     2 18430
18433 18432  H     17.777805   -4.492994    4.275884     2 18430
18434 18433  O      8.982634   29.511668   14.670931     1 18434 18435
18435 18434  H      9.887024   29.662162   14.945998     2 18433
18436 18435  H      8.898561   28.558903   14.633502     2 18433
18437 18436  O     12.019911    1.878372   25.330953     1 18437 18438
18438 18437  H     11.723696    1.774338   26.235201     2 18436
18439 18438  H     12.962624    1.716457   25.367099     2 18436
18440 18439  O     11.110978   32.661943    2.749832     1 18440 18441
18441 18440  H     11.315388   33.596954    2.735595     2 18439
18442 18441  H     10.946386   32.438296    1.833795     2 18439
18443 18442  O      8.336259   21.919167   -1.247350     1 18443 18444
18444 18443  H      7.519399   21.489720   -1.501409     2 18442
18445 18444  H      8.524310   21.578913   -0.372652     2 18442
18446 18445  O     -1.702715   36.311328    3.892247     1 18446 18447
18447 18446  H     -1.479985   36.069081    4.791101     2 18445
18448 18447  H     -2.331877   37.026671    3.985373     2 18445
18449 18448  O      2.308624   30.435837   11.050221     1 18449 18450
18450 18449  H      1.611470   30.965113   10.662826     2 18448
18451 18450  H      2.668885   30.985641   11.746037     2 18448
18452 18451  O      2.206790   20.368973   20.145707     1 18452 18453
18453 18452  H      2.907996   20.804664   19.661232     2 18451
18454 18453  H      2.524722   20.333208   21.047856     2 18451
18455 18454  O      8.126270   23.354574   20.354042     1 18455 18456
18456 18455  H      9.052695   23.156712   20.491223     2 18454
18457 18456  H      8.126621   24.172652   19.857072     2 18454
18458 18457  O     13.076500   13.497040   25.288057     1 18458 18459
18459 18458  H     12.989006   13.361340   24.344573     2 18457
18460 18459  H     12.193270   13.364704   25.632473     2 18457
18461 18460  O     13.148235   10.841328    4.868053     1 18461 18462
18462 18461  H     13.522269   10.797672    3.988040     2 18460
18463 18462  H     12.325529   11.317546    4.755789     2 18460
18464 18463  O      5.772370   10.243719   33.617438     1 18464 18465
18465 18464  H      6.240376    9.494934   33.247948     2 18463
18466 18465  H      4.994082   10.335284   33.067787     2 18463
18467 18466  O      9.423457    9.170181    7.129710     1 18467 18468
18468 18467  H      9.100598    9.067463    8.024943     2 18466
18469 18468  H      9.237403    8.330435    6.709661     2 18466
18470 18469  O     15.333393   17.764700   11.490094     1 18470 18471
18471 18470  H     14.688483   17.616701   10.798416     2 18469
18472 18471  H     15.989618   17.080735   11.356702     2 18469
18473 18472  O     27.134335   -3.137259   -0.381527     1 18473 18474
18474 18473  H     27.580016   -3.920608   -0.059093     2 18472
18475 18474  H     27.254108   -2.489871    0.313293     2 18472
18476 18475  O      2.063725   20.286174    5.737438     1 18476 18477
18477 18476  H      2.449246   20.561174    4.905584     2 18475
18478 18477  H      1.690797   21.087199    6.105562     2 18475
18479 18478  O      2.520716   -0.906130   15.043875     1 18479 18480
18480 18479  H      3.448088   -0.734662   14.880131     2 18478
18481 18480  H      2.510868   -1.423679   15.849032     2 18478
18482 18481  O      6.443830   25.290804    9.480429     1 18482 18483
18483 18482  H      6.866732   26.148282    9.434427     2 18481
18484 18483  H      5.633764   25.448443    9.965378     2 18481
18485 18484  O     16.311448    7.460433    5.511181     1 18485 18486
18486 18485  H     15.877424    8.155492    6.005900     2 18484
18487 18486  H     16.860225    7.923260    4.878041     2 18484
18488 18487  O     15.739829   25.224025    1.830042     1 18488 18489
18489 18488  H     15.486487   25.559059    0.969925     2 18487
18490 18489  H     15.222801   24.425805    1.938481     2 18487
18491 18490  O      6.757818    6.827830    8.018472     1 18491 18492
18492 18491  H      7.442738    7.246750    7.497299     2 18490
18493 18492  H      6.616999    5.981557    7.593942     2 18490
18494 18493  O     18.766330    5.183626    2.310206     1 18494 18495
18495 18494  H     17.978998    4.651201    2.423624     2 18493
18496 18495  H     19.397979    4.812213    2.926082     2 18493
18497 18496  O      3.254085    5.907480   26.722930     1 18497 18498
18498 18497  H      3.052549    6.231614   27.600742     2 18496
18499 18498  H      2.950871    6.600063   26.135886     2 18496
18500 18499  O      7.902434   12.748769    8.883496     1 18500 18501
18501 18500  H      8.565306   12.302400    9.410363     2 18499
18502 18501  H      7.960562   13.665886    9.151354     2 18499
18503 18502  O     26.747067    4.060858    5.803914     1 18503 18504
18504 18503  H     26.237033    3.643385    5.109787     2 18502
18505 18504  H     26.437362    3.648608    6.610366     2 18502
18506 18505  O      6.365004   15.896001   30.079671     1 18506 18507
18507 18506  H      7.128093   15.565856   30.553941     2 18505
18508 18507  H      6.602196   16.790940   29.836657     2 18505
18509 18508  O      8.935773   24.598152   13.779065     1 18509 18510
18510 18509  H      9.471670   24.483114   12.994328     2 18508
18511 18510  H      8.152347   24.073629   13.613685     2 18508
18512 18511  O     10.759454   -5.976252    0.893047     1 18512 18513
18513 18512  H     10.189001   -6.626875    1.302320     2 18511
18514 18513  H     11.631746   -6.369255    0.922829     2 18511
18515 18514  O      9.757218   28.104207   11.937728     1 18515 18516
18516 18515  H     10.486442   28.532942   12.385670     2 18514
18517 18516  H      9.995334   27.177191   11.924531     2 18514
18518 18517  O     13.037316    0.753791  -34.342359     1 18518 18519
18519 18518  H     13.873365    0.467440  -34.710134     2 18517
18520 18519  H     12.632442    1.269554  -35.039709     2 18517
18521 18520  O     15.162248   18.402473    2.173512     1 18521 18522
18522 18521  H     15.821071   17.709626    2.219832     2 18520
18523 18522  H     14.372800   17.962287    1.858487     2 18520
18524 18523  O      2.537999   25.473976    8.071820     1 18524 18525
18525 18524  H      1.768107   26.022355    7.920895     2 18523
18526 18525  H      3.171924   25.764617    7.416153     2 18523
18527 18526  O      8.960027   34.410600   -1.313042     1 18527 18528
18528 18527  H      9.429562   35.218244   -1.521560     2 18526
18529 18528  H      9.131048   34.267061   -0.382247     2 18526
18530 18529  O     -0.186120   25.397161   24.111522     1 18530 18531
18531 18530  H     -1.045157   25.036659   23.891691     2 18529
18532 18531  H      0.356786   24.630000   24.293038     2 18529
18533 18532  O      1.772650   22.935664    7.039042     1 18533 18534
18534 18533  H      1.825165   23.699724    7.613225     2 18532
18535 18534  H      1.021913   22.440402    7.366672     2 18532
18536 18535  O     14.868323   10.992524   23.119368     1 18536 18537
18537 18536  H     14.987108   10.947827   22.170619     2 18535
18538 18537  H     14.300091   10.250280   23.325319     2 18535
18539 18538  O     21.212769   11.953900   16.180822     1 18539 18540
18540 18539  H     21.560317   12.796110   16.474292     2 18538
18541 18540  H     20.958087   11.505287   16.987118     2 18538
18542 18541  O      3.881000   -3.631388    2.247113     1 18542 18543
18543 18542  H      3.139599   -4.007141    2.721841     2 18541
18544 18543  H      4.161531   -2.892077    2.786512     2 18541
18545 18544  O     14.714512   -0.299864   11.275917     1 18545 18546
18546 18545  H     14.807228   -0.167714   10.332428     2 18544
18547 18546  H     14.101729   -1.030745   11.356803     2 18544
18548 18547  O      6.294998   16.302794    3.333686     1 18548 18549
18549 18548  H      5.819257   17.070653    3.650379     2 18547
18550 18549  H      6.827169   16.025738    4.079518     2 18547
18551 18550  O      8.760060    8.221744   14.358968     1 18551 18552
18552 18551  H      9.160750    7.368371   14.524599     2 18550
18553 18552  H      9.384849    8.674317   13.792357     2 18550
18554 18553  O      2.646409   -2.468844    6.559491     1 18554 18555
18555 18554  H      2.124269   -3.261158    6.685348     2 18553
18556 18555  H      3.451435   -2.775693    6.142347     2 18553
18557 18556  O    -15.303736  -22.872774   -5.947171     1 18557 18558
18558 18557  H    -15.607821  -23.358225   -5.180294     2 18556
18559 18558  H    -15.252665  -21.963931   -5.651149     2 18556
18560 18559  O     18.414222   -5.220954   11.072654     1 18560 18561
18561 18560  H     18.682619   -5.762846   11.814643     2 18559
18562 18561  H     18.900568   -5.575383   10.328288     2 18559
18563 18562  O     12.184650   17.423547    3.968222     1 18563 18564
18564 18563  H     12.497623   17.368991    3.065281     2 18562
18565 18564  H     12.784297   16.866139    4.464156     2 18562
18566 18565  O     23.644195    2.947954   22.343280     1 18566 18567
18567 18566  H     23.164496    3.723391   22.634517     2 18565
18568 18567  H     24.061034    3.217020   21.524696     2 18565
18569 18568  O     19.208930   13.047878   14.651591     1 18569 18570
18570 18569  H     18.585349   12.374518   14.379626     2 18568
18571 18570  H     19.875337   12.571778   15.147033     2 18568
18572 18571  O     -3.149185   15.209780   15.956399     1 18572 18573
18573 18572  H     -2.643569   15.998021   15.758257     2 18571
18574 18573  H     -2.939462   14.604940   15.244769     2 18571
18575 18574  O     12.428953    0.747241    6.304641     1 18575 18576
18576 18575  H     12.973791   -0.031518    6.418296     2 18574
18577 18576  H     13.053448    1.457825    6.158667     2 18574
18578 18577  O      8.150019   16.807570   24.597898     1 18578 18579
18579 18578  H      8.912072   17.146391   24.128104     2 18577
18580 18579  H      7.455565   16.778957   23.939759     2 18577
18581 18580  O      2.094980   28.346741    0.462015     1 18581 18582
18582 18581  H      1.206665   28.115637    0.733527     2 18580
18583 18582  H      2.277153   27.769415   -0.279429     2 18580
18584 18583  O      3.331485   -1.690281   31.998702     1 18584 18585
18585 18584  H      2.700962   -1.001134   32.207865     2 18583
18586 18585  H      3.294712   -2.284699   32.748067     2 18583
18587 18586  O      0.056861    0.409503   16.118079     1 18587 18588
18588 18587  H     -0.743346    0.052439   15.732844     2 18586
18589 18588  H      0.765262   -0.062743   15.680605     2 18586
18590 18589  O     20.322844   28.014985    5.967926     1 18590 18591
18591 18590  H     20.574796   27.928335    5.048555     2 18589
18592 18591  H     19.749012   27.266433    6.131080     2 18589
18593 18592  O      2.181174   13.105753   22.677023     1 18593 18594
18594 18593  H      2.927289   13.324316   23.235391     2 18592
18595 18594  H      1.841527   13.952694   22.387950     2 18592
18596 18595  O     10.141129   30.033515    2.173573     1 18596 18597
18597 18596  H     10.619013   30.230022    2.979330     2 18595
18598 18597  H      9.919912   29.105058    2.246112     2 18595
18599 18598  O      4.306857   23.003955    9.443835     1 18599 18600
18600 18599  H      3.922427   23.755566    8.992697     2 18598
18601 18600  H      4.887154   22.605723    8.795068     2 18598
18602 18601  O     15.480799   27.143458   10.498612     1 18602 18603
18603 18602  H     16.069922   26.553880   10.027907     2 18601
18604 18603  H     15.957085   27.371645   11.296932     2 18601
18605 18604  O     12.680438   19.994172   10.578341     1 18605 18606
18606 18605  H     11.856910   20.149788   10.115937     2 18604
18607 18606  H     12.580948   19.121395   10.958596     2 18604
18608 18607  O      8.695547    6.699175    6.133156     1 18608 18609
18609 18608  H      9.377087    6.030849    6.061911     2 18607
18610 18609  H      8.408730    6.846481    5.231896     2 18607
18611 18610  O     26.672658    6.563413    7.067417     1 18611 18612
18612 18611  H     26.948912    6.492615    7.981147     2 18610
18613 18612  H     26.734323    5.670468    6.728182     2 18610
18614 18613  O     10.080936   -0.490280  -31.394352     1 18614 18615
18615 18614  H     10.163181   -1.198139  -30.755288     2 18613
18616 18615  H      9.584972    0.189078  -30.937489     2 18613
18617 18616  O     14.166842    6.657722   33.269663     1 18617 18618
18618 18617  H     14.715041    7.243797   33.791415     2 18616
18619 18618  H     13.641207    7.242955   32.724282     2 18616
18620 18619  O     10.374494   14.737723   17.581877     1 18620 18621
18621 18620  H     10.568798   14.715837   16.644861     2 18619
18622 18621  H      9.734928   15.443387   17.677928     2 18619
18623 18622  O      4.763658   -1.740575   21.940935     1 18623 18624
18624 18623  H      5.516452   -1.229586   21.643575     2 18622
18625 18624  H      4.585142   -1.413952   22.822798     2 18622
18626 18625  O     26.768733    0.667897   11.615628     1 18626 18627
18627 18626  H     25.989501    1.181529   11.402996     2 18625
18628 18627  H     27.147417    0.443306   10.765693     2 18625
18629 18628  O     20.041870   26.420934   -4.281463     1 18629 18630
18630 18629  H     20.205516   26.384108   -5.223851     2 18628
18631 18630  H     20.655952   25.789694   -3.906401     2 18628
18632 18631  O     14.109265   25.047143    4.588563     1 18632 18633
18633 18632  H     14.471142   25.677244    3.965466     2 18631
18634 18633  H     13.347570   24.678011    4.141579     2 18631
18635 18634  O     14.248894   22.677988    2.144060     1 18635 18636
18636 18635  H     13.401761   22.499956    1.735525     2 18634
18637 18636  H     14.205583   22.232633    2.990237     2 18634
18638 18637  O     13.574453   -1.719261    6.435448     1 18638 18639
18639 18638  H     14.202294   -1.810341    7.152213     2 18637
18640 18639  H     13.759664   -2.460295    5.858561     2 18637
18641 18640  O      9.533880   14.253574   25.640225     1 18641 18642
18642 18641  H      9.797742   14.513952   26.522728     2 18640
18643 18642  H      8.704044   14.707706   25.494050     2 18640
18644 18643  O     14.062576   14.235717    6.894418     1 18644 18645
18645 18644  H     14.637046   13.956394    6.181540     2 18643
18646 18645  H     13.668988   15.049826    6.580497     2 18643
18647 18646  O     19.507570    4.740316   24.455583     1 18647 18648
18648 18647  H     18.889106    5.465202   24.546541     2 18646
18649 18648  H     18.955465    3.962953   24.371214     2 18646
18650 18649  O     18.012441   17.638504   10.361677     1 18650 18651
18651 18650  H     17.724359   18.482609   10.709136     2 18649
18652 18651  H     18.890279   17.806918   10.019233     2 18649
18653 18652  O     14.097176    4.547160   14.701401     1 18653 18654
18654 18653  H     14.309294    4.007870   15.463243     2 18652
18655 18654  H     14.938401    4.692261   14.268367     2 18652
18656 18655  O     27.113145    1.369073    0.288354     1 18656 18657
18657 18656  H     27.903239    1.055649   -0.151815     2 18655
18658 18657  H     27.333139    2.255885    0.573660     2 18655
18659 18658  O     11.134324   18.678401   13.934718     1 18659 18660
18660 18659  H     11.099573   17.930740   13.338038     2 18658
18661 18660  H     10.655405   18.388328   14.711073     2 18658
18662 18661  O      2.040469    2.835136   35.811626     1 18662 18663
18663 18662  H      2.067297    3.139503   34.904503     2 18661
18664 18663  H      1.108152    2.733628   36.003230     2 18661
18665 18664  O     23.602800   14.024643   -2.162198     1 18665 18666
18666 18665  H     23.378153   13.125776   -1.921773     2 18664
18667 18666  H     23.666098   14.008952   -3.117174     2 18664
18668 18667  O     10.855653   21.800208    1.937179     1 18668 18669
18669 18668  H     10.809885   20.875478    1.694258     2 18667
18670 18669  H     10.383806   22.255215    1.239640     2 18667
18671 18670  O      7.000693    7.735397   11.951495     1 18671 18672
18672 18671  H      7.710276    7.724058   12.593830     2 18670
18673 18672  H      6.203155    7.805483   12.476140     2 18670
18674 18673  O     18.943282   17.772523    2.961841     1 18674 18675
18675 18674  H     18.878664   17.839463    2.009174     2 18673
18676 18675  H     19.718984   18.286395    3.186463     2 18673
18677 18676  O     35.198222   -3.365884  -10.623992     1 18677 18678
18678 18677  H     35.592301   -3.156367   -9.777212     2 18676
18679 18678  H     35.894435   -3.807931  -11.109907     2 18676
18680 18679  O     21.677196   16.100898    6.735690     1 18680 18681
18681 18680  H     22.182861   16.852204    7.045648     2 18679
18682 18681  H     20.783494   16.274747    7.031162     2 18679
18683 18682  O      9.307026   -3.719792    0.412669     1 18683 18684
18684 18683  H      9.939200   -4.434959    0.484254     2 18682
18685 18684  H      9.083867   -3.688968   -0.517644     2 18682
18686 18685  O     20.150955    4.964269   16.736212     1 18686 18687
18687 18686  H     20.064791    5.405115   15.890954     2 18685
18688 18687  H     19.405539    5.278558   17.247886     2 18685
18689 18688  O    -19.944236  -12.328602  -20.888064     1 18689 18690
18690 18689  H    -19.152909  -12.168365  -20.373906     2 18688
18691 18690  H    -20.650045  -12.350133  -20.241844     2 18688
18692 18691  O     16.919609   11.689058    7.900171     1 18692 18693
18693 18692  H     17.713622   11.203281    8.123323     2 18691
18694 18693  H     16.377564   11.637599    8.687427     2 18691
18695 18694  O     10.377852   21.195804    7.158151     1 18695 18696
18696 18695  H      9.761226   20.577439    7.550104     2 18694
18697 18696  H     10.007261   21.391337    6.297534     2 18694
18698 18697  O     10.559269    5.270996   27.190387     1 18698 18699
18699 18698  H     10.270150    5.601875   26.339999     2 18697
18700 18699  H     10.129623    5.840818   27.828305     2 18697
18701 18700  O     -3.360565   26.343475    1.903006     1 18701 18702
18702 18701  H     -4.090720   25.826174    1.563144     2 18700
18703 18702  H     -2.836886   25.718759    2.404725     2 18700
18704 18703  O     25.259730    4.329306   11.074911     1 18704 18705
18705 18704  H     25.022236    3.475563   11.436783     2 18703
18706 18705  H     25.901516    4.681287   11.691718     2 18703
18707 18706  O     10.241403   17.017938    8.993542     1 18707 18708
18708 18707  H     11.140314   17.119406    9.306424     2 18706
18709 18708  H     10.331106   16.599508    8.137329     2 18706
18710 18709  O     10.528232   22.206784   20.826805     1 18710 18711
18711 18710  H     11.040752   21.700923   21.457407     2 18709
18712 18711  H     10.983529   22.083825   19.993848     2 18709
18713 18712  O     16.610836   14.884682   18.031357     1 18713 18714
18714 18713  H     17.151394   15.605874   18.353710     2 18712
18715 18714  H     16.254413   15.203871   17.202313     2 18712
18716 18715  O      7.692317   27.901632    9.801437     1 18716 18717
18717 18716  H      8.427338   28.068980   10.391327     2 18715
18718 18717  H      6.955906   28.367609   10.197411     2 18715
18719 18718  O     22.616601   11.521061   -2.761049     1 18719 18720
18720 18719  H     21.786907   11.445546   -2.289736     2 18718
18721 18720  H     23.010274   10.651080   -2.694819     2 18718
18722 18721  O      1.803258    6.050790   24.044338     1 18722 18723
18723 18722  H      1.247805    5.710500   24.745698     2 18721
18724 18723  H      1.560180    5.536264   23.274658     2 18721
18725 18724  O     17.311101   25.952394    4.019455     1 18725 18726
18726 18725  H     17.520276   26.885431    4.063271     2 18724
18727 18726  H     16.881486   25.842341    3.171192     2 18724
18728 18727  O     22.053430   16.552901   -0.779180     1 18728 18729
18729 18728  H     22.634706   17.116997   -0.269135     2 18727
18730 18729  H     22.638721   15.923450   -1.200439     2 18727
18731 18730  O     12.565420   22.620724    6.383643     1 18731 18732
18732 18731  H     11.926683   21.986238    6.708718     2 18730
18733 18732  H     13.413671   22.263538    6.646550     2 18730
18734 18733  O      3.313840   -5.976162   28.930716     1 18734 18735
18735 18734  H      3.861537   -6.206318   28.180191     2 18733
18736 18735  H      3.935134   -5.815809   29.641006     2 18733
18737 18736  O     28.482312    2.758153    9.420514     1 18737 18738
18738 18737  H     27.767091    2.123860    9.371894     2 18736
18739 18738  H     28.442713    3.096394   10.315085     2 18736
18740 18739  O      3.365773   21.574643   14.896779     1 18740 18741
18741 18740  H      3.441809   22.004943   14.045138     2 18739
18742 18741  H      3.787409   20.724069   14.774396     2 18739
18743 18742  O     14.568347    7.074284   26.175203     1 18743 18744
18744 18743  H     14.510030    6.118981   26.160185     2 18742
18745 18744  H     15.049174    7.297923   25.378319     2 18742
18746 18745  O      4.742563   28.446257   19.704384     1 18746 18747
18747 18746  H      4.065298   28.851645   20.245868     2 18745
18748 18747  H      4.310925   28.277052   18.866953     2 18745
18749 18748  O     15.920603    7.852989   23.913849     1 18749 18750
18750 18749  H     15.815298    6.906268   23.819707     2 18748
18751 18750  H     15.523516    8.218416   23.123270     2 18748
18752 18751  O     13.919127   14.269890   20.426687     1 18752 18753
18753 18752  H     14.227244   15.097806   20.795266     2 18751
18754 18753  H     13.628860   14.494067   19.542536     2 18751
18755 18754  O     11.912710   14.559767   -1.170592     1 18755 18756
18756 18755  H     12.411559   15.016913   -1.847643     2 18754
18757 18756  H     11.042342   14.956674   -1.204594     2 18754
18758 18757  O      5.944370   33.278075    4.469986     1 18758 18759
18759 18758  H      5.994241   32.744739    5.263268     2 18757
18760 18759  H      6.211397   32.686864    3.766142     2 18757
18761 18760  O     10.226437   25.957783    2.956647     1 18761 18762
18762 18761  H     10.776061   25.237368    3.265107     2 18760
18763 18762  H     10.034642   26.467395    3.743884     2 18760
18764 18763  O     21.265412    1.381860   -6.023552     1 18764 18765
18765 18764  H     20.673493    1.477958   -5.277477     2 18763
18766 18765  H     22.114656    1.178605   -5.631500     2 18763
18767 18766  O     14.291530   15.525563    1.978771     1 18767 18768
18768 18767  H     13.650233   15.045235    1.455077     2 18766
18769 18768  H     15.140103   15.239542    1.640621     2 18766
18770 18769  O      6.141237    0.067704   26.410703     1 18770 18771
18771 18770  H      5.389095   -0.032168   26.994261     2 18769
18772 18771  H      5.958815    0.868425   25.918971     2 18769
18773 18772  O      1.142480   24.149580   13.081792     1 18773 18774
18774 18773  H      0.338668   23.720193   13.374616     2 18772
18775 18774  H      1.610416   24.359716   13.889945     2 18772
18776 18775  O     10.258862   24.107900   16.026872     1 18776 18777
18777 18776  H     11.050003   24.194115   15.494994     2 18775
18778 18777  H      9.543276   24.089552   15.391395     2 18775
18779 18778  O     12.684263   22.392556   11.616200     1 18779 18780
18780 18779  H     11.866066   22.679325   11.210552     2 18778
18781 18780  H     12.768118   21.473159   11.363397     2 18778
18782 18781  O      6.964088   23.132963   17.503256     1 18782 18783
18783 18782  H      7.084875   22.187889   17.411182     2 18781
18784 18783  H      7.758458   23.434621   17.943949     2 18781
18785 18784  O     15.228160   21.519133    6.492757     1 18785 18786
18786 18785  H     15.403580   21.164553    5.621130     2 18784
18787 18786  H     15.658401   22.374187    6.495056     2 18784
18788 18787  O     10.295866   15.099419    6.074503     1 18788 18789
18789 18788  H      9.673792   15.646167    5.594585     2 18787
18790 18789  H     11.076679   15.645879    6.163622     2 18787
18791 18790  O     17.030571    8.483154    9.398197     1 18791 18792
18792 18791  H     16.221559    8.993227    9.358751     2 18790
18793 18792  H     17.428765    8.728934   10.233221     2 18790
18794 18793  O     21.561472   -1.089274    6.332799     1 18794 18795
18795 18794  H     21.819663   -0.727219    7.180434     2 18793
18796 18795  H     21.699421   -2.032221    6.422536     2 18793
18797 18796  O     20.699780   26.937397   -0.201896     1 18797 18798
18798 18797  H     21.322593   26.401265    0.288917     2 18796
18799 18798  H     20.204497   27.405716    0.470119     2 18796
18800 18799  O    -10.639041  -18.901105  -22.783682     1 18800 18801
18801 18800  H    -11.506227  -19.270339  -22.616692     2 18799
18802 18801  H    -10.805876  -18.136238  -23.334479     2 18799
18803 18802  O     12.956882   25.208813    7.598541     1 18803 18804
18804 18803  H     13.757764   25.623082    7.277293     2 18802
18805 18804  H     12.750420   24.543990    6.941567     2 18802
18806 18805  O     17.011225    6.212325   -4.420140     1 18806 18807
18807 18806  H     16.311809    6.639052   -3.925213     2 18805
18808 18807  H     17.148277    6.779070   -5.179250     2 18805
18809 18808  O      7.796306    2.668699   10.280411     1 18809 18810
18810 18809  H      7.761610    2.856017    9.342360     2 18808
18811 18810  H      7.340102    3.404303   10.689063     2 18808
18812 18811  O      5.798793   30.636158   15.456273     1 18812 18813
18813 18812  H      5.729464   30.188214   14.613200     2 18811
18814 18813  H      6.700572   30.480790   15.737141     2 18811
18815 18814  O     24.385576   22.337710   -0.985121     1 18815 18816
18816 18815  H     24.024075   21.474327   -0.784822     2 18814
18817 18816  H     25.150032   22.156814   -1.532036     2 18814
18818 18817  O      1.797471   27.759820   19.632791     1 18818 18819
18819 18818  H      0.966395   27.419598   19.964143     2 18817
18820 18819  H      2.031379   28.458614   20.243695     2 18817
18821 18820  O     -0.319744    9.252425   -0.051370     1 18821 18822
18822 18821  H      0.454077    9.540479    0.432839     2 18820
18823 18822  H     -0.499876    8.374352    0.284449     2 18820
18824 18823  O     -0.303616   21.471543    8.207053     1 18824 18825
18825 18824  H     -0.725962   21.982771    8.897344     2 18823
18826 18825  H     -0.157985   20.611200    8.600542     2 18823
18827 18826  O      5.677866   22.554693    7.031856     1 18827 18828
18828 18827  H      6.065670   21.744846    6.700210     2 18826
18829 18828  H      4.971601   22.752074    6.416663     2 18826
18830 18829  O     35.927313   10.258850    1.396531     1 18830 18831
18831 18830  H     35.002478   10.382447    1.182908     2 18829
18832 18831  H     36.049807    9.309530    1.392300     2 18829
18833 18832  O      3.684160   11.576353   20.699822     1 18833 18834
18834 18833  H      3.928412   12.123040   19.953025     2 18832
18835 18834  H      3.455921   12.199914   21.389248     2 18832
18836 18835  O      4.876315   18.859329   18.190427     1 18836 18837
18837 18836  H      5.478311   19.403041   17.682284     2 18835
18838 18837  H      4.006165   19.184737   17.959817     2 18835
18839 18838  O      6.500645   30.227051   10.793067     1 18839 18840
18840 18839  H      5.694195   30.299724   10.282587     2 18838
18841 18840  H      7.181840   30.572466   10.216097     2 18838
18842 18841  O      9.565569   27.532040    5.192275     1 18842 18843
18843 18842  H     10.071491   27.410196    5.995660     2 18841
18844 18843  H      8.721812   27.118612    5.374983     2 18841
18845 18844  O     10.429434    9.826467   12.776815     1 18845 18846
18846 18845  H     11.303472    9.645983   13.122812     2 18844
18847 18846  H     10.113824   10.566114   13.295991     2 18844
18848 18847  O    -16.776294  -21.491045   -8.638494     1 18848 18849
18849 18848  H    -17.466278  -20.846728   -8.480348     2 18847
18850 18849  H    -16.588889  -21.858856   -7.774882     2 18847
18851 18850  O     14.965342   19.593572    8.241495     1 18851 18852
18852 18851  H     14.473595   19.754352    9.046832     2 18850
18853 18852  H     14.918097   20.420812    7.762252     2 18850
18854 18853  O      6.785923   18.304986   19.963384     1 18854 18855
18855 18854  H      7.195125   19.106464   20.289602     2 18853
18856 18855  H      6.082988   18.610616   19.390058     2 18853
18857 18856  O      9.728556    4.604149   22.163895     1 18857 18858
18858 18857  H     10.287484    3.842524   22.009754     2 18856
18859 18858  H     10.277427    5.207073   22.665346     2 18856
18860 18859  O     18.234735    2.920077   12.322750     1 18860 18861
18861 18860  H     18.324773    2.817616   13.270182     2 18859
18862 18861  H     17.314917    2.722480   12.146333     2 18859
18863 18862  O     22.836641    8.468746    6.539162     1 18863 18864
18864 18863  H     23.685933    8.657460    6.938313     2 18862
18865 18864  H     22.594705    9.281065    6.094373     2 18862
18866 18865  O     -2.075296    8.194962    3.152866     1 18866 18867
18867 18866  H     -1.402906    8.815460    3.434121     2 18865
18868 18867  H     -1.599081    7.540105    2.642363     2 18865
18869 18868  O     21.617333   -1.745207  -12.053593     1 18869 18870
18870 18869  H     22.486257   -1.465282  -12.341420     2 18868
18871 18870  H     21.406066   -2.489514  -12.617158     2 18868
18872 18871  O    -32.315661   -6.078250  -10.129643     1 18872 18873
18873 18872  H    -32.823751   -6.831156   -9.827636     2 18871
18874 18873  H    -31.524567   -6.459695  -10.510302     2 18871
18875 18874  O      0.577594   36.138534   13.979759     1 18875 18876
18876 18875  H      0.757604   35.205090   13.867904     2 18874
18877 18876  H      1.031403   36.375216   14.788629     2 18874
18878 18877  O      6.168460   16.836952   22.353751     1 18878 18879
18879 18878  H      6.657190   17.328709   21.693789     2 18877
18880 18879  H      5.991471   15.991683   21.940922     2 18877
18881 18880  O      6.037845   22.858109   12.716841     1 18881 18882
18882 18881  H      6.508827   22.703555   11.897988     2 18880
18883 18882  H      5.145795   23.072458   12.443835     2 18880
18884 18883  O      7.429368    8.713318   32.205889     1 18884 18885
18885 18884  H      6.844413    8.578832   31.460253     2 18883
18886 18885  H      7.503902    7.849427   32.611312     2 18883
18887 18886  O     12.761117   10.867039    9.200879     1 18887 18888
18888 18887  H     12.979161   10.404512    8.391709     2 18886
18889 18888  H     12.663659   11.781606    8.935735     2 18886
18890 18889  O      2.664850   23.529683   17.180299     1 18890 18891
18891 18890  H      1.862885   23.077658   17.442514     2 18889
18892 18891  H      3.062613   22.953533   16.527560     2 18889
18893 18892  O    -22.977199   -7.676065  -16.881330     1 18893 18894
18894 18893  H    -22.990667   -7.478642  -15.944807     2 18892
18895 18894  H    -23.900124   -7.707872  -17.133183     2 18892
18896 18895  O      3.565718   28.378574    2.705104     1 18896 18897
18897 18896  H      3.121465   28.125016    1.896043     2 18895
18898 18897  H      4.147214   29.093294    2.445743     2 18895
18899 18898  O    -23.074736  -25.954550   -0.727369     1 18899 18900
18900 18899  H    -22.666940  -26.783695   -0.477466     2 18898
18901 18900  H    -23.896730  -25.934081   -0.237330     2 18898
18902 18901  O      8.313745   19.025714    8.556612     1 18902 18903
18903 18902  H      7.522610   18.581673    8.861838     2 18901
18904 18903  H      9.015088   18.389419    8.696178     2 18901
18905 18904  O      4.883262    0.655251   32.051076     1 18905 18906
18906 18905  H      4.343575   -0.103609   32.272663     2 18904
18907 18906  H      5.048549    1.085396   32.890055     2 18904
18908 18907  O      3.570153   20.221786    8.010268     1 18908 18909
18909 18908  H      3.071732   20.094879    7.202987     2 18907
18910 18909  H      4.016502   21.059606    7.887537     2 18907
18911 18910  O     -4.721586   -4.414493   23.002781     1 18911 18912
18912 18911  H     -3.984645   -4.907504   22.642099     2 18910
18913 18912  H     -4.800093   -4.725649   23.904584     2 18910
18914 18913  O      6.665742   31.784073   -1.131077     1 18914 18915
18915 18914  H      6.792778   30.927278   -0.723650     2 18913
18916 18915  H      7.552086   32.118922   -1.267094     2 18913
18917 18916  O      9.396221   24.317194    7.250095     1 18917 18918
18918 18917  H      9.532101   23.771596    6.475440     2 18916
18919 18918  H      8.671390   24.895375    7.012275     2 18916
18920 18919  O    -29.156643  -11.468046  -13.161843     1 18920 18921
18921 18920  H    -29.487105  -10.997514  -13.927105     2 18919
18922 18921  H    -29.836908  -11.354487  -12.498083     2 18919
18923 18922  O     -0.029330   12.088561   21.242428     1 18923 18924
18924 18923  H      0.806023   12.545847   21.338902     2 18922
18925 18924  H     -0.145447   11.997867   20.296635     2 18922
18926 18925  O      3.410201   10.461718    3.775115     1 18926 18927
18927 18926  H      3.838786   10.409842    4.629430     2 18925
18928 18927  H      3.334879    9.551471    3.488741     2 18925
18929 18928  O    -26.347592  -10.117656  -15.327911     1 18929 18930
18930 18929  H    -25.595255  -10.696224  -15.452328     2 18928
18931 18930  H    -27.001800  -10.437744  -15.949029     2 18928
18932 18931  O     11.625242   -1.517461   15.523578     1 18932 18933
18933 18932  H     11.852620   -0.954247   14.783767     2 18931
18934 18933  H     11.253617   -2.302845   15.121958     2 18931
18935 18934  O     11.795638   11.771106   15.044595     1 18935 18936
18936 18935  H     12.617371   11.308885   14.879252     2 18934
18937 18936  H     12.059361   12.674617   15.218806     2 18934
18938 18937  O     15.587812   30.547219    6.253575     1 18938 18939
18939 18938  H     15.348397   29.895904    6.912894     2 18937
18940 18939  H     14.760463   30.774451    5.829204     2 18937
18941 18940  O     25.043883   11.333653    5.269331     1 18941 18942
18942 18941  H     25.980753   11.441819    5.105605     2 18940
18943 18942  H     24.948315   10.414316    5.518167     2 18940
18944 18943  O     11.886535    3.537478    9.476532     1 18944 18945
18945 18944  H     11.415320    3.665853   10.299762     2 18943
18946 18945  H     11.198171    3.446367    8.817679     2 18943
18947 18946  O      1.499865   32.284037   -0.781624     1 18947 18948
18948 18947  H      2.371188   32.338111   -1.174185     2 18946
18949 18948  H      1.545981   32.855795   -0.015335     2 18946
18950 18949  O    -21.136813  -20.899323  -11.809413     1 18950 18951
18951 18950  H    -20.844570  -21.485661  -11.111536     2 18949
18952 18951  H    -22.000162  -20.599357  -11.525018     2 18949
18953 18952  O     24.503208   -2.653241    7.891567     1 18953 18954
18954 18953  H     24.352803   -2.870201    6.971492     2 18952
18955 18954  H     24.398169   -3.484484    8.354422     2 18952
18956 18955  O     12.013441   26.254360   14.446574     1 18956 18957
18957 18956  H     11.066890   26.111975   14.447173     2 18955
18958 18957  H     12.172226   26.815318   15.205748     2 18955
18959 18958  O     10.587725   16.275329   12.806650     1 18959 18960
18960 18959  H     10.283259   16.510963   11.930289     2 18958
18961 18960  H     11.108584   15.483144   12.674817     2 18958
18962 18961  O     18.950148    2.525518   14.836597     1 18962 18963
18963 18962  H     18.287868    2.061125   15.348414     2 18961
18964 18963  H     19.733151    1.979242   14.905303     2 18961
18965 18964  O     13.348870   12.867761    0.354556     1 18965 18966
18966 18965  H     12.686995   13.405753   -0.079861     2 18964
18967 18966  H     12.846180   12.262794    0.900037     2 18964
18968 18967  O     13.522714   -3.411990   18.949584     1 18968 18969
18969 18968  H     12.948193   -4.177488   18.936531     2 18967
18970 18969  H     12.996088   -2.710138   18.567092     2 18967
18971 18970  O     11.492556    5.472891   30.617352     1 18971 18972
18972 18971  H     11.030530    6.119869   31.150442     2 18970
18973 18972  H     11.792139    5.962787   29.851530     2 18970
18974 18973  O     14.684907   13.614138   14.227253     1 18974 18975
18975 18974  H     15.492318   14.124880   14.168425     2 18973
18976 18975  H     14.922353   12.849404   14.751689     2 18973
18977 18976  O     12.627269   17.978998    1.220453     1 18977 18978
18978 18977  H     12.499138   17.929830    0.273143     2 18976
18979 18978  H     11.864068   18.459468    1.541237     2 18976
18980 18979  O      3.485696   23.286678   12.051516     1 18980 18981
18981 18980  H      3.644569   23.144335   11.118388     2 18979
18982 18981  H      2.552825   23.493739   12.107279     2 18979
18983 18982  O      3.840204   33.923159    1.567106     1 18983 18984
18984 18983  H      3.997022   33.283992    0.872048     2 18982
18985 18984  H      3.662277   34.742015    1.104451     2 18982
18986 18985  O      8.282652   -1.577629   14.451674     1 18986 18987
18987 18986  H      9.039226   -2.153628   14.561458     2 18985
18988 18987  H      8.623853   -0.821751   13.973697     2 18985
18989 18988  O     21.304320    1.927849   20.021349     1 18989 18990
18990 18989  H     20.474381    2.241160   20.380888     2 18988
18991 18990  H     21.965991    2.237793   20.639701     2 18988
18992 18991  O     23.508094   14.143926   12.641364     1 18992 18993
18993 18992  H     22.838871   13.459925   12.618679     2 18991
18994 18993  H     23.351156   14.659549   11.850330     2 18991
18995 18994  O      9.918764    2.670241   12.109999     1 18995 18996
18996 18995  H      9.369102    2.358926   11.390843     2 18994
18997 18996  H      9.344724    2.652690   12.875768     2 18994
18998 18997  O     -0.858071    2.256833  -35.861307     1 18998 18999
18999 18998  H     -0.447761    1.573359  -36.391157     2 18997
19000 18999  H     -0.345635    2.273945  -35.053007     2 18997
19001 19000  O      5.656883   22.168556   20.330457     1 19001 19002
19002 19001  H      5.464013   22.542900   19.470864     2 19000
19003 19002  H      6.447307   22.624822   20.619044     2 19000
19004 19003  O      6.019213    5.497772   17.737968     1 19004 19005
19005 19004  H      6.088905    4.545624   17.807183     2 19003
19006 19005  H      6.297343    5.821668   18.594686     2 19003
19007 19006  O      8.774423   15.649511   14.903398     1 19007 19008
19008 19007  H      8.897969   14.774769   14.534897     2 19006
19009 19008  H      9.242489   16.230748   14.303974     2 19006
19010 19009  O    -34.067051   -7.821586  -12.324043     1 19010 19011
19011 19010  H    -34.825644   -8.313647  -12.638117     2 19009
19012 19011  H    -33.712290   -7.401541  -13.107586     2 19009
19013 19012  O     -2.046255   24.474704   22.111823     1 19013 19014
19014 19013  H     -2.227655   23.569471   22.364568     2 19012
19015 19014  H     -2.649101   24.647356   21.388636     2 19012
19016 19015  O      7.853238  -28.255972    6.692965     1 19016 19017
19017 19016  H      7.139071  -27.622459    6.762666     2 19015
19018 19017  H      8.232794  -28.287321    7.571136     2 19015
19019 19018  O     17.008587   18.751112    6.592973     1 19019 19020
19020 19019  H     16.462798   19.031652    7.327577     2 19018
19021 19020  H     17.640800   19.460721    6.478987     2 19018
19022 19021  O      6.687919   21.014152   23.149811     1 19022 19023
19023 19022  H      7.137832   20.497736   22.481137     2 19021
19024 19023  H      6.375275   21.789728   22.684013     2 19021
19025 19024  O    -18.670739   -1.342787   34.053468     1 19025 19026
19026 19025  H    -18.904746   -0.774042   34.786953     2 19024
19027 19026  H    -19.454834   -1.869500   33.898545     2 19024
19028 19027  O    -28.211470   -4.934694  -19.022970     1 19028 19029
19029 19028  H    -28.452918   -4.347963  -19.739685     2 19027
19030 19029  H    -28.848701   -4.746707  -18.333892     2 19027
19031 19030  O      1.863422   34.066476    6.125962     1 19031 19032
19032 19031  H      2.115051   33.437686    5.449546     2 19030
19033 19032  H      1.240229   34.649205    5.692039     2 19030
19034 19033  O    -23.339766  -18.744606   -4.559556     1 19034 19035
19035 19034  H    -22.948321  -19.181288   -3.803042     2 19033
19036 19035  H    -23.834413  -18.015122   -4.186180     2 19033
19037 19036  O      1.442988   33.335904   15.596028     1 19037 19038
19038 19037  H      1.783157   32.723075   16.247916     2 19036
19039 19038  H      1.847801   34.173839   15.820132     2 19036
19040 19039  O     -0.177739   -6.034261   18.468070     1 19040 19041
19041 19040  H     -0.391293   -6.090543   17.536696     2 19039
19042 19041  H     -1.023099   -5.916872   18.901450     2 19039
19043 19042  O      6.790409   14.187777   21.710382     1 19043 19044
19044 19043  H      7.131583   13.458059   22.227434     2 19042
19045 19044  H      7.452161   14.332830   21.034161     2 19042
19046 19045  O     11.565817   35.260319    3.068008     1 19046 19047
19047 19046  H     11.959410   35.774448    2.363034     2 19045
19048 19047  H     11.116771   35.905778    3.613876     2 19045
19049 19048  O     18.816792   23.162991   -1.352269     1 19049 19050
19050 19049  H     18.619343   23.749289   -0.621858     2 19048
19051 19050  H     19.735305   23.336854   -1.558031     2 19048
19052 19051  O     19.074517   20.660314    6.550275     1 19052 19053
19053 19052  H     19.410557   21.126412    7.315822     2 19051
19054 19053  H     19.807725   20.118784    6.258070     2 19051
19055 19054  O     14.262879    4.243314   26.019511     1 19055 19056
19056 19055  H     13.693309    3.777526   26.631772     2 19054
19057 19056  H     14.907513    3.590240   25.747166     2 19054
19058 19057  O     17.363807   20.996559   -1.824965     1 19058 19059
19059 19058  H     17.963573   21.706843   -1.596913     2 19057
19060 19059  H     16.894625   20.808351   -1.012144     2 19057
19061 19060  O      4.245750   18.463318   23.358031     1 19061 19062
19062 19061  H      4.839881   17.858112   22.914223     2 19060
19063 19062  H      3.385207   18.050229   23.286930     2 19060
19064 19063  O     13.381629   20.781048   -0.462748     1 19064 19065
19065 19064  H     12.830915   21.381516   -0.965126     2 19063
19066 19065  H     13.055854   19.910015   -0.689474     2 19063
19067 19066  O     16.711947    0.581293   21.504760     1 19067 19068
19068 19067  H     16.121674   -0.125246   21.766699     2 19066
19069 19068  H     17.479496    0.133347   21.149169     2 19066
19070 19069  O      6.022500    3.021692   15.126480     1 19070 19071
19071 19070  H      5.337880    2.403051   14.871903     2 19069
19072 19071  H      6.143252    2.873426   16.064386     2 19069
19073 19072  O     17.656207   28.710375    3.979667     1 19073 19074
19074 19073  H     17.349014   29.493565    3.523073     2 19072
19075 19074  H     17.692180   28.968186    4.900792     2 19072
19076 19075  O      4.785612   10.217508    6.004507     1 19076 19077
19077 19076  H      4.213665   10.795423    6.509603     2 19075
19078 19077  H      5.406773    9.873660    6.646503     2 19075
19079 19078  O     15.952043   20.339069    0.335177     1 19079 19080
19080 19079  H     15.108382   20.443175   -0.104856     2 19078
19081 19080  H     15.769316   19.751769    1.068608     2 19078
19082 19081  O      0.101778   10.362507  -35.544922     1 19082 19083
19083 19082  H     -0.421289   10.749094  -34.842652     2 19081
19084 19083  H      0.973135   10.742290  -35.432084     2 19081
19085 19084  O      8.431100   20.164383   21.218276     1 19085 19086
19086 19085  H      9.038975   20.833557   20.903750     2 19084
19087 19086  H      8.922356   19.345273   21.155356     2 19084
19088 19087  O      6.796949    4.953901   29.066902     1 19088 19089
19089 19088  H      7.605562    4.866467   29.571610     2 19087
19090 19089  H      6.449788    4.063463   29.013698     2 19087
19091 19090  O      7.726850   19.193989   14.915294     1 19091 19092
19092 19091  H      6.997052   18.598281   15.084876     2 19090
19093 19092  H      7.568991   19.520864   14.029593     2 19090
19094 19093  O      8.219310   34.727180    4.664422     1 19094 19095
19095 19094  H      7.289581   34.499520    4.667049     2 19093
19096 19095  H      8.567007   34.325454    5.460635     2 19093
19097 19096  O     12.034612    9.654927   29.173449     1 19097 19098
19098 19097  H     12.575831    9.830898   29.943090     2 19096
19099 19098  H     11.135945    9.674491   29.502456     2 19096
19100 19099  O     12.421211    2.294027   36.082000     1 19100 19101
19101 19100  H     12.224257    1.563513   35.495663     2 19099
19102 19101  H     13.005241    2.857990   35.574963     2 19099
19103 19102  O     31.721821   -0.643260    3.337642     1 19103 19104
19104 19103  H     32.132993    0.185367    3.091578     2 19102
19105 19104  H     31.931134   -0.748758    4.265699     2 19102
19106 19105  O     12.369167   14.412138   15.394366     1 19106 19107
19107 19106  H     13.186209   14.297553   14.909037     2 19105
19108 19107  H     12.515016   15.192637   15.928949     2 19105
19109 19108  O     15.761599    3.265568   -4.174542     1 19109 19110
19110 19109  H     16.446199    3.930098   -4.251713     2 19108
19111 19110  H     14.995699    3.660528   -4.591238     2 19108
19112 19111  O      9.712207    3.123183    3.540435     1 19112 19113
19113 19112  H      9.035784    3.473774    2.960978     2 19111
19114 19113  H      9.623339    2.173049    3.465743     2 19111
19115 19114  O      4.763603   11.098197   25.774820     1 19115 19116
19116 19115  H      5.114833   10.499184   25.115994     2 19114
19117 19116  H      4.610159   11.914663   25.299351     2 19114
19118 19117  O    -19.940838  -27.481577   -3.594774     1 19118 19119
19119 19118  H    -19.717066  -26.913655   -4.332081     2 19117
19120 19119  H    -20.292912  -26.887183   -2.932225     2 19117
19121 19120  O     14.678553    5.378871   23.038643     1 19121 19122
19122 19121  H     15.225990    4.635557   22.785606     2 19120
19123 19122  H     13.927377    4.983971   23.481384     2 19120
19124 19123  O      5.887343   13.539724    7.136676     1 19124 19125
19125 19124  H      6.244274   13.231601    7.969678     2 19123
19126 19125  H      5.035966   13.107989    7.066014     2 19123
19127 19126  O      5.468861    2.200760   29.448316     1 19127 19128
19128 19127  H      5.568249    1.736195   30.279299     2 19126
19129 19128  H      4.571954    2.010975   29.173050     2 19126
19130 19129  O     20.023483    6.820343   14.456583     1 19130 19131
19131 19130  H     20.782470    7.309461   14.138883     2 19129
19132 19131  H     19.271670    7.363260   14.219411     2 19129
19133 19132  O      6.238284    8.578747   21.646185     1 19133 19134
19134 19133  H      7.075575    8.908932   21.320373     2 19132
19135 19134  H      5.763278    9.361888   21.924198     2 19132
19136 19135  O      9.815296    9.291437   30.691648     1 19136 19137
19137 19136  H      9.563774    8.609610   31.314610     2 19135
19138 19137  H      9.262416   10.039264   30.918166     2 19135
19139 19138  O      7.911782    0.743433   31.936619     1 19139 19140
19140 19139  H      7.073994    0.832713   32.390901     2 19138
19141 19140  H      8.126786   -0.186400   32.010202     2 19138
19142 19141  O     22.120060    3.123056   17.727097     1 19142 19143
19143 19142  H     21.427517    3.697789   17.401064     2 19141
19144 19143  H     21.658792    2.455856   18.235337     2 19141
19145 19144  O     18.434524    9.129352    4.771785     1 19145 19146
19146 19145  H     18.873003    9.158085    5.622163     2 19144
19147 19146  H     17.996625    9.977378    4.698792     2 19144
19148 19147  O     21.007358   32.245403   -0.504174     1 19148 19149
19149 19148  H     20.662907   31.581269   -1.101260     2 19147
19150 19149  H     21.857106   32.483759   -0.874776     2 19147
19151 19150  O     19.880451    8.814386   24.239918     1 19151 19152
19152 19151  H     20.762484    9.047546   24.529550     2 19150
19153 19152  H     19.335543    8.922166   25.019464     2 19150
19154 19153  O     18.070679    6.395869   26.604038     1 19154 19155
19155 19154  H     18.950565    6.703401   26.821883     2 19153
19156 19155  H     17.590174    7.189813   26.369516     2 19153
19157 19156  O     25.814461    9.590103   16.706256     1 19157 19158
19158 19157  H     25.775942    8.920815   17.389485     2 19156
19159 19158  H     26.006857    9.103834   15.904534     2 19156
19160 19159  O     -0.998291   33.840507    7.948428     1 19160 19161
19161 19160  H     -0.750840   34.560841    7.368670     2 19159
19162 19161  H     -0.761145   34.145110    8.824333     2 19159
19163 19162  O     -8.305947   22.446889   21.623121     1 19163 19164
19164 19163  H     -8.927577   23.159222   21.772752     2 19162
19165 19164  H     -8.847153   21.713547   21.330654     2 19162
19166 19165  O     13.556357    1.406164   20.662397     1 19166 19167
19167 19166  H     14.366364    1.655685   21.107211     2 19165
19168 19167  H     13.835935    0.798412   19.977777     2 19165
19169 19168  O    -11.095107  -22.436189  -13.156520     1 19169 19170
19170 19169  H    -11.318108  -23.313737  -12.846017     2 19168
19171 19170  H    -10.999665  -21.916307  -12.358494     2 19168
19172 19171  O      6.585550   10.917940   19.512724     1 19172 19173
19173 19172  H      7.179387   11.286793   20.166588     2 19171
19174 19173  H      6.286213   11.673520   19.007028     2 19171
19175 19174  O      6.852056   20.313262   17.359871     1 19175 19176
19176 19175  H      7.590646   19.842690   17.746238     2 19174
19177 19176  H      6.883791   20.087863   16.430129     2 19174
19178 19177  O     31.104295    5.227962   10.824340     1 19178 19179
19179 19178  H     31.842462    4.647967   11.011276     2 19177
19180 19179  H     30.420776    4.646662   10.490987     2 19177
19181 19180  O     13.839921    3.783920   17.736056     1 19181 19182
19182 19181  H     13.578884    2.863986   17.693462     2 19180
19183 19182  H     13.026476    4.256236   17.913416     2 19180
19184 19183  O      1.037147   14.646795  -36.326584     1 19184 19185
19185 19184  H      1.840333   14.866997  -35.854740     2 19183
19186 19185  H      0.996219   15.282941  -37.040639     2 19183
19187 19186  O    -30.278221   -3.827253  -17.678806     1 19187 19188
19188 19187  H    -30.248435   -2.939159  -18.034661     2 19186
19189 19188  H    -30.609827   -3.717687  -16.787591     2 19186
19190 19189  O      9.740200    6.940908   32.193711     1 19190 19191
19191 19190  H      9.220295    6.734695   32.970503     2 19189
19192 19191  H     10.534882    7.348498   32.538069     2 19189
19193 19192  O      1.461143    4.323408   33.603224     1 19193 19194
19194 19193  H      1.197453    3.733979   32.896632     2 19192
19195 19194  H      0.700000    4.886925   33.742298     2 19192
19196 19195  O     11.333418   31.738493   -0.065944     1 19196 19197
19197 19196  H     11.108595   31.967745   -0.967681     2 19195
19198 19197  H     10.754292   31.006762    0.147163     2 19195
19199 19198  O     20.708096   12.928166    1.760217     1 19199 19200
19200 19199  H     21.579430   13.048537    2.137736     2 19198
19201 19200  H     20.125487   12.863774    2.516955     2 19198
19202