matteoferla/Fragmenstein

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fragmenstein/demo/mac1_mols/mac-x0344.mol

Summary

Maintainability
Test Coverage
mac-x0344
     RDKit          3D

 12 12  0  0  0  0  0  0  0  0999 V2000
    1.7120   13.6970   -4.5620 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2840   12.8950   -3.7020 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5750   13.1020   -2.5090 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4000   11.7220   -4.1640 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0360   10.8500   -3.4690 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0360   11.6960   -5.5460 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8100   10.6790   -6.1100 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0170   10.3320   -5.5140 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8600    9.4020   -6.0870 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5170    8.7970   -7.2820 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3320    9.1260   -7.8650 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4880   10.0740   -7.3010 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
  4  6  1  0
  6  7  1  0
  7  8  2  0
  8  9  1  0
  9 10  2  0
 10 11  1  0
  7 12  1  0
 11 12  2  0
M  END