matteoferla/Fragmenstein

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fragmenstein/demo/mac1_mols/diamond-x0792_A.mol

Summary

Maintainability
Test Coverage

     RDKit          3D

  9  9  0  0  0  0  0  0  0  0999 V2000
    4.6980   23.1720   16.4500 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.7390   21.0100   17.2790 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6770   20.5540   16.3180 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.0430   22.2790   16.8350 C   0  0  1  0  0  0  0  0  0  0  0  0
    5.5790   21.9970   16.4960 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4430   24.4260   16.2950 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4630   24.6560   17.4060 C   0  0  2  0  0  0  0  0  0  0  0  0
    7.5090   25.6660   16.9650 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1190   23.3660   17.9050 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  5  1  0
  1  6  1  0
  5  4  1  0
  6  7  1  0
  2  3  1  0
  4  2  1  1
  4  9  1  0
  9  7  1  0
  7  8  1  6
M  END