matteoferla/Fragmenstein

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fragmenstein/demo/mac1_mols/diamond-x0711_A.mol

Summary

Maintainability
Test Coverage

     RDKit          3D

 14 14  0  0  0  0  0  0  0  0999 V2000
   -1.6110   15.1660   -2.5640 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4270   12.9330   -4.0700 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3090   14.8530   -4.0480 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8220   14.8760   -1.8690 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4090   14.5330    1.6630 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0890   13.4570   -2.0280 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7970   14.6290   -0.5030 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.5550   14.6920   -0.2600 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9770   14.5500    0.2140 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2010   14.7070   -0.4190 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2230   14.9410   -1.7880 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0470   15.0170   -2.5100 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4830   14.6390    0.3470 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5170   14.1120   -3.1460 S   0  0  1  0  0  0  0  0  0  0  0  0
  1  4  1  0
  1 14  1  0
  4  7  2  0
  4 12  1  0
 14  2  1  6
 14  3  2  0
 14  6  2  0
  7  9  1  0
 12 11  2  0
  5 13  1  0
 13  8  2  0
 13 10  1  0
  9 10  2  0
 10 11  1  0
M  END