matteoferla/Fragmenstein

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fragmenstein/demo/mac1_mols/diamond-x0852_B.mol

Summary

Maintainability
Test Coverage

     RDKit          3D

 10 10  0  0  0  0  0  0  0  0999 V2000
   -9.5480   17.6680    7.2020 N   0  0  0  0  0  0  0  0  0  0  0  0
   -8.3650   15.3460    4.8410 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.6860   14.8960    5.9260 O   0  0  0  0  0  0  0  0  0  0  0  0
   -9.1890   16.4790    4.9390 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.3690   17.1300    6.2100 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.8810   16.9420    3.8250 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.7550   16.2610    2.6330 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.9690   15.1310    2.5170 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2680   14.6800    3.6210 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.6110   16.9560    1.0870 Br  0  0  0  0  0  0  0  0  0  0  0  0
  1  5  3  0
  5  4  1  0
  2  3  1  0
  2  4  2  0
  2  9  1  0
  4  6  1  0
  9  8  2  0
  6  7  2  0
  7  8  1  0
  7 10  1  0
M  END