2butanone.mol
  -ISIS-            3D

 13 12  0  0  0  0  0  0  0  0  0
   -0.0160   -0.0802   -0.0698 O   0  0  0  0  0
    1.2120   -0.0264   -0.0214 C   0  0  0  0  0
    1.9632    1.3042   -0.0035 C   0  0  0  0  0
    1.0611    2.5447    0.0110 C   0  0  0  0  0
    0.3883    2.5531   -0.8625 H   0  0  0  0  0
    0.4239    2.5591    0.9107 H   0  0  0  0  0
    1.6662    3.4669   -0.0038 H   0  0  0  0  0
    2.6468    1.2898    0.8702 H   0  0  0  0  0
    2.6363    1.3084   -0.8863 H   0  0  0  0  0
    2.0645   -1.2887    0.0105 C   0  0  0  0  0
    2.7171   -1.3249   -0.8815 H   0  0  0  0  0
    2.7280   -1.2877    0.8948 H   0  0  0  0  0
    1.4176   -2.1785    0.0303 H   0  0  0  0  0
  1  2  2  0  0  0
  2  3  1  0  0  0
  2 10  1  0  0  0
  3  4  1  0  0  0
  3  8  1  0  0  0
  3  9  1  0  0  0
  4  5  1  0  0  0
  4  6  1  0  0  0
  4  7  1  0  0  0
 10 11  1  0  0  0
 10 12  1  0  0  0
 10 13  1  0  0  0
M  END