matteoferla/Fragmenstein

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fragmenstein/demo/mac1_mols/diamond-x0301_B.mol

Summary

Maintainability
Test Coverage

     RDKit          3D

 12 12  0  0  0  0  0  0  0  0999 V2000
   18.6030   28.6670    5.5820 N   0  0  0  0  0  0  0  0  0  0  0  0
   21.4590   27.2740    6.3440 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.7480   27.8260    3.8000 O   0  0  0  0  0  0  0  0  0  0  0  0
   20.0940   26.7860    5.9350 C   0  0  2  0  0  0  0  0  0  0  0  0
   18.2390   30.1540    3.7370 N   0  0  0  0  0  0  0  0  0  0  0  0
   20.2240   25.4490    5.2280 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.6010   31.2960    3.5980 N   0  0  0  0  0  0  0  0  0  0  0  0
   19.4810   27.8000    4.9970 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9590   31.4940    4.7250 N   0  0  0  0  0  0  0  0  0  0  0  0
   17.9570   29.7340    4.9830 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.1310   30.5380    5.6340 N   0  0  0  0  0  0  0  0  0  0  0  0
   16.0890   32.6430    4.9410 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  8  1  0
  1 10  1  0
  8  3  2  0
  8  4  1  0
 10  5  1  0
 10 11  2  0
  4  2  1  6
  4  6  1  0
  5  7  2  0
  7  9  1  0
  9 11  1  0
  9 12  1  0
M  END