matteoferla/Fragmenstein

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fragmenstein/demo/mac1_mols/diamond-x0421_A.mol

Summary

Maintainability
Test Coverage

     RDKit          3D

 11 12  0  0  0  0  0  0  0  0999 V2000
   -3.7050   15.0780   -2.9380 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9080   14.8950   -1.8940 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6770   14.8000   -1.9950 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5530   14.9170   -0.5550 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9100   14.9310    1.6130 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9430   14.9440    0.6660 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9330   14.8790   -0.3780 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0790   14.8890    0.9410 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3450   14.8130    1.7050 C   0  0  1  0  0  0  0  0  0  0  0  0
   -7.6640   14.8940    0.9920 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2270   13.6070    1.5650 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  0
  2  4  1  0
  4  6  2  0
  4  7  1  0
  6  5  1  0
  7  8  2  0
  5  8  1  0
  9  8  1  6
  9 10  1  0
  9 11  1  0
 10 11  1  0
M  END