matteoferla/Fragmenstein

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fragmenstein/demo/test_mols/mac-x0138.mol

Summary

Maintainability
Test Coverage
mac-x0138
     RDKit          3D

 12 13  0  0  0  0  0  0  0  0999 V2000
   -1.1230   15.0350   -3.3720 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1440   15.0810   -2.3370 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4380   15.2320   -2.5340 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0390   15.2380   -1.4050 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0960   15.0470   -0.4470 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1050   14.9260    0.9520 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3060   15.0140    1.7720 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9730   14.7050    1.5590 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8420   14.6170    0.9000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3420   14.4170    1.6660 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7560   14.7110   -0.3760 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9100   14.9350   -1.0570 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  2  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  6  8  2  0
  8  9  1  0
  9 10  1  0
  9 11  2  0
  2 12  1  0
  5 12  2  0
 11 12  1  0
M  END