matteoferla/Fragmenstein

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fragmenstein/demo/mpro_mols/Mpro-x10019.mol

Summary

Maintainability
Test Coverage
x10019
     RDKit          3D

 22 24  0  0  0  0  0  0  0  0999 V2000
    6.9580    0.6060   17.6630 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.1840    0.4320   21.5930 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8410    0.8100   20.8600 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.8050    0.4450   20.2200 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9090   -0.3530   21.1090 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.1180    0.9930   19.1410 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1340   -1.6440   23.2790 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.7230    1.0500   17.9010 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8280   -5.1710   25.4410 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.6280    0.0840   18.6980 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1090   -0.0250   19.9900 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2320   -0.1670   21.2850 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9280   -1.2040   22.1470 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3610   -2.7980   23.9780 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4590   -3.5980   23.7430 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6400   -4.7530   24.4870 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7290   -4.3980   25.7100 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8330   -4.8310   26.7140 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7020   -4.1130   26.9860 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4190   -2.9460   26.2900 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2640   -2.4920   25.3210 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4470   -3.2040   25.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  4  1  0
  4  6  2  0
  1  8  2  0
  6  8  1  0
  1 10  1  0
  4 11  1  0
  5 11  1  0
 10 11  2  0
  3 12  2  0
  5 12  1  0
  7 13  1  0
 12 13  1  0
  7 14  1  0
 14 15  2  0
  9 16  2  0
 15 16  1  0
  9 17  1  0
 17 18  2  0
 18 19  1  0
 19 20  2  0
 20 21  1  0
 14 22  1  0
 17 22  1  0
 21 22  2  0
M  END