deHMeacetater.mol -ISIS- 3D 10 9 0 0 0 0 0 0 0 0 0 0.0637 0.0046 0.1165 O 0 0 0 0 0 1.4408 0.0193 0.1612 C 0 0 0 0 0 2.0002 1.1114 0.3319 O 0 0 0 0 0 2.1899 -1.2161 0.0438 C 0 0 0 0 0 1.7408 -2.2110 0.1105 H 0 0 0 0 0 3.2757 -1.1231 -0.0354 H 0 0 0 0 0 -0.6302 -1.2436 -0.1249 C 0 0 0 0 0 -1.6903 -0.9733 -0.2363 H 0 0 0 0 0 -0.2770 -1.7269 -1.0539 H 0 0 0 0 0 -0.5205 -1.9334 0.7322 H 0 0 0 0 0 1 2 1 0 0 0 1 7 1 0 0 0 2 3 2 0 0 0 2 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 2 M END