matteoferla/Fragmenstein

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fragmenstein/demo/mac1_mols/mac-x0394.mol

Summary

Maintainability
Test Coverage
mac-x0394
     RDKit          3D

 12 12  0  0  0  0  0  0  0  0999 V2000
    1.1760   18.2960   -4.7640 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -3.2590   15.5420   -5.3830 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    0.1620   11.3640   -3.1520 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6730   12.5110   -2.9570 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8900   13.0570   -1.8630 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1730   13.1710   -4.2510 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4450   14.4480   -4.5820 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1240   15.6600   -4.5190 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3840   16.7590   -4.7560 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9090   16.7510   -5.0500 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5530   15.6020   -5.0510 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8780   14.4420   -4.7730 C   0  0  0  0  0  0  0  0  0  0  0  0
  3  4  1  0
  4  5  2  0
  4  6  1  0
  6  7  1  0
  7  8  2  0
  1  9  1  0
  8  9  1  0
  9 10  2  0
  2 11  1  0
 10 11  1  0
  7 12  1  0
 11 12  2  0
M  END