matteoferla/Fragmenstein

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fragmenstein/demo/mac1_mols/diamond-x0655_B.mol

Summary

Maintainability
Test Coverage

     RDKit          3D

 17 18  0  0  0  0  0  0  0  0999 V2000
   14.9610   30.8670  -18.1180 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.9920   32.2070  -19.8710 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2750   29.8410  -19.9840 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.4170   30.8710  -19.3360 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9300   28.0790  -13.6430 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.5610   29.6930  -17.5060 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7280   29.0620  -16.3840 C   0  0  2  0  0  0  0  0  0  0  0  0
   14.7430   29.9830  -15.1410 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2090   29.2750  -13.9140 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7980   27.1470  -14.7230 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3630   27.6990  -16.0170 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2940   28.8690  -16.8940 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9550   27.7360  -17.6300 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6930   27.6000  -18.1810 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7490   28.5890  -18.0080 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0650   29.7190  -17.2810 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3260   29.8560  -16.7210 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  4  1  0
  1  6  1  0
  4  2  1  0
  4  3  2  0
  7  6  1  6
  5  9  1  0
  5 10  1  0
  9  8  1  0
 10 11  1  0
  7  8  1  0
  7 11  1  0
  7 12  1  0
 12 13  2  0
 12 17  1  0
 13 14  1  0
 17 16  2  0
 14 15  2  0
 15 16  1  0
M  END