matteoferla/Fragmenstein

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fragmenstein/demo/mpro_mols/Mpro-x0305.mol

Summary

Maintainability
Test Coverage
x0305
     RDKit          3D

 11 11  0  0  0  0  0  0  0  0999 V2000
    8.3830   -0.0160   27.4180 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9410   -0.5650   26.1240 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0760    0.2400   25.7110 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.9040   -0.2020   24.6160 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5520   -1.3350   23.8940 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3420   -1.7500   22.8400 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4720   -1.0160   22.5320 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3670   -1.4560   21.3810 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0490   -1.7600   20.5260 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.7670    0.1100   23.2980 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9850    0.4890   24.3080 N   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  2  0
  5  6  1  0
  6  7  2  0
  7  8  1  0
  8  9  3  0
  7 10  1  0
  4 11  1  0
 10 11  2  0
M  END