H2CCcHCN.mol
  -ISIS-            3D

  7  5  0  0  0  0  0  0  0  0  0
   -2.8967    0.0112    0.0012 C   0  0  0  0  0
    1.7614   -0.0043   -0.0023 C   0  0  0  0  0
   -3.5084    0.9269    0.0063 H   0  0  0  0  0
   -3.4229   -0.9581    0.0056 H   0  0  0  0  0
   -1.5995    0.0404   -0.0078 C   0  0  0  0  0
    0.6664    0.0240   -0.0137 H   0  0  0  0  0
    2.9269   -0.0373    0.0134 N   0  0  0  0  0
  1  3  1  0  0  0
  1  4  1  0  0  0
  1  5  2  0  0  0
  2  6  1  0  0  0
  2  7  3  0  0  0