2GIU_FBR_A_600
     RDKit          3D

 39 41  0  0  0  0  0  0  0  0999 V2000
   22.9210    9.0370  115.3330 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.4450    8.0850  116.4500 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.9070    8.1950  116.5030 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.3470    7.7940  115.1540 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.2410    7.3180  115.1040 O   0  0  0  0  0  0  0  0  0  0  0  0
   21.1430    8.0220  113.9260 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.4090    7.1960  112.5220 Br  0  0  0  0  0  0  0  0  0  0  0  0
   22.3490    8.6250  113.9990 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.4070    8.7370  112.9720 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.3580    8.6780  111.5750 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.5470    8.8530  110.8570 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.7740    9.0260  111.5250 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.9270    9.1090  110.8390 O   0  0  0  0  0  0  0  0  0  0  0  0
   25.8120    9.0600  112.9240 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.6150    8.9510  113.6350 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.4460    9.0220  115.1340 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.4130   10.4820  115.5210 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.1370   11.2900  116.6040 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.2290   12.2960  117.3190 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.0160   12.8190  118.5400 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.7432    7.0516  116.2195 H   0  0  0  0  0  0  0  0  0  0  0  0
   22.8939    8.3552  117.4172 H   0  0  0  0  0  0  0  0  0  0  0  0
   20.5141    7.5245  117.2815 H   0  0  0  0  0  0  0  0  0  0  0  0
   20.6121    9.2278  116.7403 H   0  0  0  0  0  0  0  0  0  0  0  0
   22.4068    8.4982  111.0527 H   0  0  0  0  0  0  0  0  0  0  0  0
   24.5222    8.8554  109.7573 H   0  0  0  0  0  0  0  0  0  0  0  0
   27.7880    9.1710  111.3237 H   0  0  0  0  0  0  0  0  0  0  0  0
   26.7692    9.1708  113.4546 H   0  0  0  0  0  0  0  0  0  0  0  0
   24.9024    9.9383  115.5365 H   0  0  0  0  0  0  0  0  0  0  0  0
   24.9342    8.1861  115.6564 H   0  0  0  0  0  0  0  0  0  0  0  0
   22.5311   11.0119  114.5643 H   0  0  0  0  0  0  0  0  0  0  0  0
   21.3664   10.3986  115.8492 H   0  0  0  0  0  0  0  0  0  0  0  0
   23.5392   10.5902  117.3513 H   0  0  0  0  0  0  0  0  0  0  0  0
   23.9308   11.8652  116.1050 H   0  0  0  0  0  0  0  0  0  0  0  0
   21.9806   13.1282  116.6439 H   0  0  0  0  0  0  0  0  0  0  0  0
   21.2856   11.8238  117.6306 H   0  0  0  0  0  0  0  0  0  0  0  0
   22.5198   12.4893  119.4647 H   0  0  0  0  0  0  0  0  0  0  0  0
   24.0416   12.4221  118.5126 H   0  0  0  0  0  0  0  0  0  0  0  0
   23.0473   13.9182  118.5126 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  1  8  1  0
  1 16  1  0
  1 17  1  0
  2  3  1  0
  3  4  1  0
  4  5  2  0
  4  6  1  0
  6  7  1  0
  6  8  2  0
  8  9  1  0
  9 10  2  0
  9 15  1  0
 10 11  1  0
 11 12  2  0
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 12 14  1  0
 14 15  2  0
 15 16  1  0
 17 18  1  0
 18 19  1  0
 19 20  1  0
  2 21  1  0
  2 22  1  0
  3 23  1  0
  3 24  1  0
 10 25  1  0
 11 26  1  0
 13 27  1  0
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 18 34  1  0
 19 35  1  0
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 20 39  1  0
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M  END
