matteoferla/Fragmenstein

     RDKit          3D

 25 27  0  0  0  0  0  0  0  0999 V2000
    5.0930    1.0900   17.7200 Br  0  0  0  0  0  0  0  0  0  0  0  0
    5.6610   -0.0100   19.1510 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9750   -1.3220   18.8940 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3900   -2.1330   19.9420 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8590   -3.5550   19.9410 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8120   -4.4250   19.5620 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.1140   -3.8060   21.4200 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3710   -4.8730   21.9420 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7380    0.5220   20.4190 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1290   -0.2850   21.4850 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1100    0.2900   22.8810 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4700   -1.6190   21.2180 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0290   -2.5980   22.0650 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.4920   -2.3910   23.4330 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8560   -1.7490   23.5060 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2640   -1.1140   24.6730 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4810   -0.4610   24.7330 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9320    0.2480   25.8140 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.1220    0.2490   26.9970 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7020   -1.7320   22.4030 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9340   -1.1050   22.4480 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3330   -0.4660   23.6150 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5410    0.1510   23.7990 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.4830    0.1160   22.7290 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3670   -3.5940   18.8050 S   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  1  0
  5  6  1  6
  7  5  1  0
  8  7  2  0
  9  2  1  0
 10  9  2  0
 11 10  1  0
 12 10  1  0
 12  4  2  0
 13 12  1  0
 13  7  1  0
 14 13  1  0
 15 14  1  0
 16 15  2  0
 17 16  1  0
 18 17  1  0
 19 18  1  0
 20 15  1  0
 21 20  2  0
 22 17  2  0
 22 21  1  0
 23 22  1  0
 24 23  1  0
  5 25  1  0
M  END