matteoferla/Fragmenstein

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fragmenstein/demo/mpro_mols/Mpro-x1132.mol

Summary

Maintainability
Test Coverage
x1132
     RDKit          3D

 15 16  0  0  0  0  0  0  0  0999 V2000
    7.3900  -23.3170   -1.3150 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0710  -21.8430   -0.9990 C   0  0  1  0  0  0  0  0  0  0  0  0
    7.6580  -20.9390   -2.0810 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1500  -19.5900   -2.1560 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.6510  -18.6160   -3.1060 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1950  -17.5200   -3.1300 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.7640  -18.9760   -4.0920 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2740  -17.7540   -4.6880 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.9830  -16.8370   -4.0550 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2670  -15.8290   -4.9550 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6830  -16.1950   -6.1570 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0860  -17.3600   -5.9810 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.1060  -19.2820   -1.2100 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1500  -20.4190   -0.8540 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6750  -21.7300   -0.8700 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  6
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  2  0
  5  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  2  0
 10 11  1  0
  8 12  1  0
 11 12  2  0
  4 13  1  0
 13 14  1  0
  2 15  1  0
 14 15  1  0
M  END