matteoferla/Fragmenstein

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fragmenstein/demo/mpro_mols/Mpro-x0995.mol

Summary

Maintainability
Test Coverage
x0995
     RDKit          3D

  7  7  0  0  0  0  0  0  0  0999 V2000
    3.7000    2.0980   19.5460 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.6670    1.2610   19.1410 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1070    0.1800   19.9470 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0330   -0.6950   19.5290 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.5510   -0.4730   18.2740 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2180    0.5280   17.4370 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.2800    1.3840   17.8650 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  0
  3  4  1  0
  4  5  2  0
  5  6  1  0
  2  7  1  0
  6  7  2  0
M  END