allylalcholrad.mol
  -ISIS-            3D

  9  8  0  0  0  0  0  0  0  0  0
    0.0008    0.0068    0.0000 C   0  0  0  0  0
    1.3909    0.0029    0.0001 C   0  0  0  0  0
    1.9507    0.9416    0.0000 H   0  0  0  0  0
    1.9542   -0.9356    0.0000 H   0  0  0  0  0
   -0.8219   -1.1208   -0.0005 C   0  0  0  0  0
   -0.2705   -2.3838    0.0003 O   0  0  0  0  0
   -0.9818   -3.0490   -0.0009 H   0  0  0  0  0
   -1.9147   -1.0537    0.0001 H   0  0  0  0  0
   -0.5331    0.9667    0.0003 H   0  0  0  0  0
  1  2  1  0  0  0
  1  5  2  0  0  0
  1  9  1  0  0  0
  2  3  1  0  0  0
  2  4  1  0  0  0
  5  6  1  0  0  0
  5  8  1  0  0  0
  6  7  1  0  0  0
M  END