matteoferla/Fragmenstein

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fragmenstein/demo/mac1_mols/diamond-x0626_A.mol

Summary

Maintainability
Test Coverage

     RDKit          3D

 11 11  0  0  0  0  0  0  0  0999 V2000
   -4.9620   14.6560    1.2970 N   0  0  0  0  0  0  0  0  0  0  0  0
   -8.6020   14.4720    0.8030 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2450   14.8410   -0.5800 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3290   14.4730    1.5350 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6350   14.6490    1.4030 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1470   14.6770    0.6310 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7310   14.7060    0.6880 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5230   14.7350    0.5800 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1610   14.6220    1.1880 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8060   14.8640   -0.7400 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5080   14.8580   -1.0200 S   0  0  0  0  0  0  0  0  0  0  0  0
  1  6  1  0
  1  7  1  0
  6  3  2  0
  6  4  1  0
  7  5  2  0
  7 11  1  0
  2  4  1  0
  5  8  1  0
  8  9  1  0
  8 10  2  0
 11 10  1  0
M  END