NMeacetamidep.mol
  -ISIS-            3D

 11 11  0  0  0  0  0  0  0  0  0
   -0.0306   -0.0693   -0.0617 O   0  0  0  0  0
    1.2291   -0.0128   -0.0023 C   0  0  0  0  0
    1.1726    1.3506    0.0364 N   0  0  0  0  0
    1.0703    2.1350    1.2086 C   0  0  0  0  0
    2.0239    2.7361    1.1432 H   0  0  0  0  0
    0.3000    2.9218    1.0787 H   0  0  0  0  0
    1.0202    1.5964    2.1697 H   0  0  0  0  0
    2.2872   -1.0098   -0.0879 C   0  0  0  0  0
    2.8280   -0.8589   -1.0460 H   0  0  0  0  0
    3.0261   -0.8712    0.7234 H   0  0  0  0  0
    1.8588   -2.0252   -0.0686 H   0  0  0  0  0
  1  2  2  0  0  0
  1  3  1  0  0  0
  2  3  1  0  0  0
  2  8  1  0  0  0
  3  4  1  0  0  0
  4  5  1  0  0  0
  4  6  1  0  0  0
  4  7  1  0  0  0
  8  9  1  0  0  0
  8 10  1  0  0  0
  8 11  1  0  0  0
<CHARGE>
 1