matteoferla/Fragmenstein

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fragmenstein/demo/mac1_mols/mac-x0546.mol

Summary

Maintainability
Test Coverage
mac-x0546
     RDKit          3D

 15 16  0  0  0  0  0  0  0  0999 V2000
   -4.4850   15.3400   -5.5980 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7150   16.4910   -5.3260 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3190   16.3940   -5.1990 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5470   17.5330   -5.2770 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1810   17.5150   -5.1450 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4660   16.3040   -4.9100 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7550   15.9950   -4.7450 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.9060   14.7180   -4.5710 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6690   14.1360   -4.6200 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3890   12.6680   -4.4480 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4270   12.1360   -3.0280 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8400   12.7260   -2.0110 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0270   10.9880   -2.9170 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2870   15.1680   -4.8550 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6740   15.2160   -4.9790 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  2  0
  4  5  1  0
  5  6  2  0
  6  7  1  0
  7  8  1  0
  8  9  2  0
  9 10  1  0
 10 11  1  0
 11 12  2  0
 11 13  1  0
  6 14  1  0
  9 14  1  0
  3 15  1  0
 14 15  2  0
M  END