CH3-plan.mol
  -ISIS-            3D

  4  3  0  0  0  0  0  0  0  0  0
    0.0177    0.0196    0.0227 C   0  0  0  0  0
    1.1111    0.0211    0.0421 H   0  0  0  0  0
   -0.5302    0.9658    0.0053 H   0  0  0  0  0
   -0.5275   -0.9280    0.0259 H   0  0  0  0  0
  1  2  1  0  0  0
  1  3  1  0  0  0
  1  4  1  0  0  0
<CHARGE>
 -1