propylimmoniump.mol
  -ISIS-            3D

 12 11  0  0  0  0  0  0  0  0  0
   -0.0126   -0.0060    0.0058 C   0  0  0  0  0
    1.2897    0.0011    0.0061 N   0  0  0  0  0
    1.8306    0.8748    0.0004 H   0  0  0  0  0
    1.8271   -0.8766    0.0071 H   0  0  0  0  0
   -0.8343   -1.2259   -0.0357 C   0  0  0  0  0
   -0.2246   -2.1395    0.0844 H   0  0  0  0  0
   -1.5515   -1.1720    0.8099 H   0  0  0  0  0
   -1.6545   -1.2564   -1.3700 C   0  0  0  0  0
   -0.9865   -1.3172   -2.2439 H   0  0  0  0  0
   -2.2966   -2.1516   -1.3563 H   0  0  0  0  0
   -2.3053   -0.3725   -1.4772 H   0  0  0  0  0
   -0.5054    0.9788   -0.0036 H   0  0  0  0  0
  1  2  2  0  0  0
  1  5  1  0  0  0
  1 12  1  0  0  0
  2  3  1  0  0  0
  2  4  1  0  0  0
  5  6  1  0  0  0
  5  7  1  0  0  0
  5  8  1  0  0  0
  8  9  1  0  0  0
  8 10  1  0  0  0
  8 11  1  0  0  0
<CHARGE>
1
M  END