matteoferla/Fragmenstein

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fragmenstein/demo/mac1_mols/mac-x0455.mol

Summary

Maintainability
Test Coverage
mac-x0455
     RDKit          3D

 12 12  0  0  0  0  0  0  0  0999 V2000
   -2.1440   14.4000   -2.4430 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9830   14.2000   -3.3950 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.9610   15.3650   -4.1050 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2070   14.1160   -2.4650 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8430   15.1320   -2.1260 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6090   13.0570   -1.9890 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0250   12.9850   -4.3300 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0450   12.7130   -5.1180 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0270   11.6060   -5.9600 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0630   10.7560   -5.9830 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1390   11.0160   -5.1760 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1010   12.1670   -4.3540 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  1
  2  3  1  0
  2  4  1  0
  4  5  2  0
  4  6  1  0
  2  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