babelxyz.mol
example_mol chemdig rzepa

 12 12  0  0  0  0  0  0  0  0  0
   -1.2230    0.6750    0.0000 C   0  0  0  0  0
   -0.0260    1.3960    0.0000 C   0  0  0  0  0
    1.1960    0.7210    0.0000 C   0  0  0  0  0
    1.2220   -0.6760    0.0000 C   0  0  0  0  0
    0.0260   -1.3960    0.0000 C   0  0  0  0  0
   -1.1960   -0.7210    0.0000 C   0  0  0  0  0
   -2.1710    1.2000    0.0000 H   0  0  0  0  0
   -0.0470    2.4800    0.0000 H   0  0  0  0  0
    2.1250    1.2810    0.0000 H   0  0  0  0  0
    2.1710   -1.2000    0.0000 H   0  0  0  0  0
    0.0470   -2.4800    0.0000 H   0  0  0  0  0
   -2.1250   -1.2810    0.0000 H   0  0  0  0  0
  1  2  2  0  0  0
  1  6  1  0  0  0
  1  7  1  0  0  0
  2  3  1  0  0  0
  2  8  1  0  0  0
  3  4  2  0  0  0
  3  9  1  0  0  0
  4  5  1  0  0  0
  4 10  1  0  0  0
  5  6  2  0  0  0
  5 11  1  0  0  0
  6 12  1  0  0  0
M  END