matteoferla/Fragmenstein

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fragmenstein/demo/mac1_mols/mac-x0373.mol

Summary

Maintainability
Test Coverage
mac-x0373
     RDKit          3D

 16 17  0  0  0  0  0  0  0  0999 V2000
    0.3020   13.0680   -1.5980 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0140   14.2150   -2.0570 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8350   15.1370   -1.9050 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3230   14.4910   -2.7670 C   0  0  1  0  0  0  0  0  0  0  0  0
   -1.7080   13.2370   -3.5690 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0380   12.9520   -4.7470 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3510   11.8090   -5.4750 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3210   10.9310   -5.0150 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9960   11.2100   -3.8430 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6690   12.3490   -3.1180 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4180   14.9410   -1.7850 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5900   15.4960   -2.2740 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5920   15.9260   -1.4280 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4270   15.7780   -0.0710 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2590   15.2190    0.4260 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2490   14.8090   -0.4220 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  0
  4  2  1  1
  4  5  1  0
  5  6  2  0
  6  7  1  0
  7  8  2  0
  8  9  1  0
  5 10  1  0
  9 10  2  0
  4 11  1  0
 11 12  2  0
 12 13  1  0
 13 14  2  0
 14 15  1  0
 11 16  1  0
 15 16  2  0
M  END