matteoferla/Fragmenstein

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fragmenstein/demo/mpro_mols/Mpro-x1226.mol

Summary

Maintainability
Test Coverage
x1226
     RDKit          3D

 10 10  0  0  0  0  0  0  0  0999 V2000
   22.8790  -20.2580   23.3300 N   0  0  0  0  0  0  0  0  0  0  0  0
   23.8320  -18.0390   24.0300 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.9550  -18.7840   23.0140 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.6420  -24.1350   24.0690 N   0  0  0  0  0  0  0  0  0  0  0  0
   21.6320  -20.5910   24.0930 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.2720  -23.6690   22.8380 N   0  0  0  0  0  0  0  0  0  0  0  0
   21.2140  -22.0050   23.9080 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.6070  -22.4390   22.7340 N   0  0  0  0  0  0  0  0  0  0  0  0
   21.2500  -23.0960   24.7830 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.4260  -25.5260   24.5080 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  3  1  0
  2  3  1  0
  1  5  1  0
  4  6  1  0
  5  7  1  0
  6  8  2  0
  7  8  1  0
  4  9  1  0
  7  9  2  0
  4 10  1  0
M  END