deHMeacetatep.mol
  -ISIS-            3D

 10 10  0  0  0  0  0  0  0  0  0
    0.1318    0.0257   -0.0020 O   0  0  0  0  0
    1.3915   -0.0375   -0.0006 C   0  0  0  0  0
    2.2899    0.8761   -0.0019 O   0  0  0  0  0
    2.6816   -0.6883    0.0009 C   0  0  0  0  0
    3.1371   -0.9985   -0.9489 H   0  0  0  0  0
    3.1360   -0.9960    0.9521 H   0  0  0  0  0
   -0.7009   -1.2377   -0.0015 C   0  0  0  0  0
   -1.7313   -0.8618    0.0021 H   0  0  0  0  0
   -0.4748   -1.7960   -0.9209 H   0  0  0  0  0
   -0.4703   -1.7999    0.9145 H   0  0  0  0  0
  1  2  1  0  0  0
  1  7  1  0  0  0
  2  3  1  0  0  0
  2  4  1  0  0  0
  3  4  1  0  0  0
  4  5  1  0  0  0
  4  6  1  0  0  0
  7  8  1  0  0  0
  7  9  1  0  0  0
  7 10  1  0  0  0
<CHARGE>
1
M  END