matteoferla/Fragmenstein

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fragmenstein/demo/mac1_mols/diamond-x0844_A.mol

Summary

Maintainability
Test Coverage

     RDKit          3D

  8  8  0  0  0  0  0  0  0  0999 V2000
   -5.7750   14.8860    1.1520 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3900   14.9090   -0.0720 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.6270   14.8810   -0.1300 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5350   14.9920   -1.1850 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1960   15.0200   -1.0180 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6000   15.0250    0.2710 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4300   14.9600    1.3240 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0840   14.9390   -2.5360 Br  0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  1  7  1  0
  2  3  2  0
  2  4  1  0
  7  6  2  0
  4  5  2  0
  5  6  1  0
  5  8  1  0
M  END