matteoferla/Fragmenstein

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fragmenstein/demo/mac1_mols/mac-x0436.mol

Summary

Maintainability
Test Coverage
mac-x0436
     RDKit          3D

 16 17  0  0  0  0  0  0  0  0999 V2000
    0.8300   10.9820   -2.9230 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1590   12.1480   -2.9580 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3190   12.7910   -1.9000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4760   12.7910   -4.3180 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2820   13.2350   -5.0640 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5070   12.0230   -5.4670 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0060   11.2480   -6.5100 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7070   10.0430   -6.9000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2320    9.2940   -7.9470 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9430    8.1420   -8.3530 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0970    7.8040   -7.6880 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5800    8.5390   -6.6220 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8940    9.6940   -6.2370 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4020   10.4630   -5.1290 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6870   11.6340   -4.7380 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0850   12.2820   -3.8660 O   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  1  0
  6  7  2  0
  7  8  1  0
  8  9  2  0
  9 10  1  0
 10 11  2  0
 11 12  1  0
  8 13  1  0
 12 13  2  0
 13 14  1  0
  6 15  1  0
 14 15  1  0
 15 16  2  0
M  END