matteoferla/Fragmenstein

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fragmenstein/demo/mac1_mols/diamond-x0628_A.mol

Summary

Maintainability
Test Coverage

     RDKit          3D

 12 12  0  0  0  0  0  0  0  0999 V2000
   -1.9180   10.4690   -5.5410 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9490    9.0530   -7.3650 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5520   10.9710   -2.9490 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9240   10.2330   -6.4620 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3690   12.0110   -5.5440 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.1950   12.8340   -1.9640 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5270   11.6020   -5.0080 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0390   11.1310   -6.5090 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2690   12.3640   -3.9700 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5030   13.1300   -5.1880 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6150   12.6960   -4.2500 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0780   12.0680   -2.9970 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  4  1  0
  1  7  2  0
  4  2  1  0
  4  8  2  0
  7  5  1  0
  7  9  1  0
  3 12  2  0
 12  6  1  0
 12 11  1  0
  8  5  1  0
  5 10  1  0
 10 11  1  0
M  END