matteoferla/Fragmenstein

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fragmenstein/demo/mpro_mols/Mpro-x0107.mol

Summary

Maintainability
Test Coverage
x0107
     RDKit          3D

 11 11  0  0  0  0  0  0  0  0999 V2000
   10.0450   -0.6630   22.5460 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1480   -0.0440   21.4760 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4740    0.9690   20.9600 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.9020   -0.6880   21.1000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.0480   -0.1040   20.0780 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4210   -0.1700   18.7420 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6690    0.3470   17.7900 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.5370    0.9500   18.0780 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0830    1.0730   19.3850 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8540    0.5290   20.4130 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4110    0.6350   21.8710 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  0
  2  4  1  0
  4  5  1  0
  5  6  2  0
  6  7  1  0
  7  8  2  0
  8  9  1  0
  5 10  1  0
  9 10  2  0
 10 11  1  0
M  END