matteoferla/Fragmenstein

View on GitHub
fragmenstein/demo/test_mols/rototoluene.mol

Summary

Maintainability
Test Coverage
toluene
  PyMOL2.3          3D                             0

  7  7  0  0  0  0  0  0  0  0999 V2000
   -0.7500   -1.2990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7500    1.2991    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7499    1.2991    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4999    0.0001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7500   -1.2989    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5001   -2.5980    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  1  6  1  0  0  0  0
  6  7  1  0  0  0  0
M  END