matteoferla/Fragmenstein

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fragmenstein/demo/mac1_mols/mac-x0527.mol

Summary

Maintainability
Test Coverage
mac-x0527
     RDKit          3D

 16 17  0  0  0  0  0  0  0  0999 V2000
   -3.6930   15.1840   -3.6370 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1170   15.0720   -2.6170 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7200   14.7650   -2.6110 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0650   14.6760   -3.8790 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0690   13.2850   -4.5150 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0190   12.3250   -4.2440 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9540   11.1020   -4.9050 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9800   10.8320   -5.8270 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0380   11.7980   -6.1010 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0760   13.0030   -5.4320 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8190   15.1020   -1.2530 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1970   15.1310   -1.1990 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8350   15.1180   -0.0680 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1460   15.0680    1.0620 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7580   15.0180    1.0080 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1330   15.0460   -0.1470 N   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  3  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
  2 11  1  0
 11 12  2  0
 12 13  1  0
 13 14  2  0
 14 15  1  0
 11 16  1  0
 15 16  2  0
M  END