matteoferla/Fragmenstein

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fragmenstein/demo/mac1_mols/mac-x0213.mol

Summary

Maintainability
Test Coverage
mac-x0213
     RDKit          3D

 12 13  0  0  0  0  0  0  0  0999 V2000
   -0.1120   11.6020   -2.9430 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3170   12.7530   -2.8410 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8380   13.1520   -1.7590 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1450   13.6740   -4.0270 C   0  0  1  0  0  0  0  0  0  0  0  0
   -1.3160   14.1270   -4.0140 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2270   15.5690   -4.5450 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2200   16.3660   -5.0800 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9080   17.6460   -5.5240 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6000   18.1260   -5.4480 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3930   17.3070   -4.9450 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0730   16.0330   -4.4870 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9840   14.9450   -3.8940 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  1  0
  6  7  2  0
  7  8  1  0
  8  9  2  0
  9 10  1  0
  6 11  1  0
 10 11  2  0
  4 12  1  0
 11 12  1  0
M  END