matteoferla/Fragmenstein

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fragmenstein/demo/mac1_mols/mac-x0228.mol

Summary

Maintainability
Test Coverage
mac-x0228
     RDKit          3D

 12 13  0  0  0  0  0  0  0  0999 V2000
   -1.0650   14.6080   -1.8450 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0110   14.7050   -2.6300 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8120   14.6700   -3.8850 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4140   14.8390   -2.0490 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4290   15.1900   -2.9240 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7160   15.3270   -2.4900 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0300   15.0920   -1.1620 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3380   15.1410   -0.5270 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1460   14.4600    0.7230 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7030   14.6040    1.0700 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0340   14.7670   -0.2450 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6770   14.6510   -0.6890 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  5  2  0
  5  6  1  0
  6  7  2  0
  7  8  1  0
  8  9  1  0
  9 10  1  0
  7 11  1  0
 10 11  1  0
  4 12  1  0
 11 12  2  0
M  END