1A9U_SB2_A_800
     RDKit          3D

 43 46  0  0  0  0  0  0  0  0999 V2000
   -0.9400   21.5700   27.8010 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7670   22.3460   28.2870 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5880   21.2640   27.4030 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.4630   17.2150   27.7730 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0750   18.5630   27.5900 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0690   19.5790   27.6130 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4440   19.2780   27.8020 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8260   17.9330   27.9810 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8520   16.8530   27.9720 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4690    9.3540   28.9050 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0330   10.1300   27.8840 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5600   11.4490   27.6850 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5720   11.9530   28.5980 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9890   11.0570   29.6830 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4080    9.7650   29.7890 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3470   14.4320   28.2060 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.2550   15.4900   28.1830 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5760   15.1690   28.3810 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.5530   13.7840   28.5630 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1500   13.3030   28.4790 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3380   13.3370   30.1690 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5350   12.7070   30.5430 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1890   11.8340   29.6380 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6360   11.5840   28.3390 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4270   12.2190   27.9600 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7550   13.1100   28.8800 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3550   11.2330   30.0350 F   0  0  0  0  0  0  0  0  0  0  0  0
    1.6340   22.2239   29.3721 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7955   22.0708   28.0104 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5809   23.3943   28.0104 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3041   16.4267   27.7641 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9824   18.8217   27.4319 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1971   20.0798   27.8086 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8891   17.6939   28.1315 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7354    9.7435   27.1984 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2025   12.0715   26.8515 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7471   11.3840   30.4099 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7248    9.0910   30.5986 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3282   14.4661   28.0583 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8395   14.0158   30.8766 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9656   12.8907   31.5384 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.1466   10.9040   27.6413 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9987   12.0338   26.9639 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  3  2  0
  2  3  1  0
  3  6  1  0
  4  5  2  0
  4  9  1  0
  5  6  1  0
  6  7  2  0
  7  8  1  0
  8  9  2  0
  9 17  1  0
 10 11  2  0
 10 15  1  0
 11 12  1  0
 12 13  2  0
 13 14  1  0
 13 20  1  0
 14 15  2  0
 16 17  1  0
 16 20  1  0
 17 18  2  0
 18 19  1  0
 19 20  2  0
 19 26  1  0
 21 22  2  0
 21 26  1  0
 22 23  1  0
 23 24  2  0
 23 27  1  0
 24 25  1  0
 25 26  2  0
  2 28  1  0
  2 29  1  0
  2 30  1  0
  4 31  1  0
  5 32  1  0
  7 33  1  0
  8 34  1  0
 11 35  1  0
 12 36  1  0
 14 37  1  0
 15 38  1  0
 16 39  1  0
 21 40  1  0
 22 41  1  0
 24 42  1  0
 25 43  1  0
A    1
O2
A    2
C1
A    3
S1
A    4
CA1
A    5
CA2
A    6
CA3
A    7
CA4
A    8
CA5
A    9
CA6
A   10
NB1
A   11
CB2
A   12
CB3
A   13
CB4
A   14
CB5
A   15
CB6
A   16
NC1
A   17
CC2
A   18
NC3
A   19
CC4
A   20
CC5
A   21
CD1
A   22
CD2
A   23
CD3
A   24
CD4
A   25
CD5
A   26
CD6
A   27
FD3
M  END
