matteoferla/Fragmenstein

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fragmenstein/demo/mpro_mols/Mpro-x10359.mol

Summary

Maintainability
Test Coverage
x10359
     RDKit          3D

 18 19  0  0  0  0  0  0  0  0999 V2000
    6.7730    0.5300   17.5590 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.3920    0.8190   21.6370 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5640    0.5720   20.9720 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.8610    0.6730   20.2120 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7180   -0.7590   20.8790 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.4010    0.8880   25.4300 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1980    1.3240   19.1790 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6770    1.2220   17.8890 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4160   -0.1080   18.5420 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0030   -0.0750   19.8750 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9590   -0.4470   21.3030 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5640   -1.4670   22.2440 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9300   -1.0260   22.7100 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0700   -1.3540   21.9910 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3160   -0.9050   22.3940 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4420   -0.1310   23.5360 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3090    0.1780   24.2750 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0610   -0.2570   23.8600 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  4  1  0
  4  7  2  0
  1  8  2  0
  7  8  1  0
  1  9  1  0
  4 10  1  0
  5 10  1  0
  9 10  2  0
  3 11  2  0
  5 11  1  0
 11 12  1  0
 12 13  1  0
 13 14  2  0
 14 15  1  0
 15 16  2  0
  6 17  1  0
 16 17  1  0
 13 18  1  0
 17 18  2  0
M  END