matteoferla/Fragmenstein

     RDKit          3D

 18 19  0  0  0  0  0  0  0  0999 V2000
   13.7300   -1.9080   21.3300 Br  0  0  0  0  0  0  0  0  0  0  0  0
   12.4340   -0.9800   22.3590 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8520   -0.0310   23.2720 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8940    0.5870   24.0610 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5520    0.2830   23.8940 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1060   -1.3040   22.1910 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1450   -0.6440   22.9450 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6810   -0.8690   22.6530 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2440   -0.1030   21.4220 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8610    0.8770   21.0120 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.0990   -0.5470   20.8720 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.4550    0.0670   19.7750 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3110    0.8510   19.9910 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7370    1.0700   21.3680 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9660   -0.0380   18.4850 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4280    0.5810   17.4300 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.3390    1.3270   17.6460 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7530    1.4810   18.8850 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0
  3  2  2  0
  4  3  1  0
  5  4  2  0
  6  2  1  0
  7  5  1  0
  7  6  2  0
  8  7  1  0
  9  8  1  0
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 13 12  2  0
 14 13  1  0
 15 12  1  0
 16 15  2  0
 17 16  1  0
 18 17  2  0
 18 13  1  0
M  END