pentenolrp.mol
  -ISIS-            3D

 16 15  0  0  0  0  0  0  0  0  0
   -0.1315    0.1934   -0.2773 H   0  0  0  0  0
    0.9428    0.0799   -0.3406 O   0  0  0  0  0
    1.5041    1.2137   -0.1232 C   0  0  0  0  0
    0.6644    2.4307    0.1098 C   0  0  0  0  0
    0.5545    2.9027   -0.8957 H   0  0  0  0  0
    1.2318    3.1635    0.7115 H   0  0  0  0  0
   -0.7282    2.1085    0.7135 C   0  0  0  0  0
   -0.6165    1.7910    1.7664 H   0  0  0  0  0
   -1.3052    3.0631    0.7487 H   0  0  0  0  0
   -1.5040    1.0994   -0.0789 C   0  0  0  0  0
   -1.6647    1.2669   -1.1553 H   0  0  0  0  0
   -2.2390    0.4638    0.4300 H   0  0  0  0  0
    2.9801    1.2478   -0.1132 C   0  0  0  0  0
    3.3573    2.1887   -0.5524 H   0  0  0  0  0
    3.4184    0.3608   -0.5954 H   0  0  0  0  0
    3.3014    1.2609    0.9523 H   0  0  0  0  0
  1  2  1  0  0  0
  2  3  1  0  0  0
  3  4  1  0  0  0
  3 13  1  0  0  0
  4  5  1  0  0  0
  4  6  1  0  0  0
  4  7  1  0  0  0
  7  8  1  0  0  0
  7  9  1  0  0  0
  7 10  1  0  0  0
 10 11  1  0  0  0
 10 12  1  0  0  0
 13 14  1  0  0  0
 13 15  1  0  0  0
 13 16  1  0  0  0
M  END