HMDB0031352 RDKit 3D Cyclohexyl acetate 24 24 0 0 0 0 0 0 0 0999 V2000 3.9639 -0.1157 0.3936 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5890 -0.5117 0.0258 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3840 -1.5624 -0.6174 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5106 0.2703 0.3856 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2277 -0.1277 0.0255 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6623 -0.2881 1.2271 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0869 -0.5367 0.8795 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6426 0.3297 -0.1914 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6814 0.3636 -1.3853 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3995 0.9747 -0.8358 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6862 -0.8762 0.0324 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1692 0.8981 -0.0115 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9770 -0.0223 1.5146 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2017 -1.0916 -0.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6224 0.6838 1.7969 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3210 -1.1387 1.8758 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2990 -1.6068 0.6142 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6973 -0.3469 1.8109 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6348 -0.0347 -0.4723 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6781 1.3868 0.1825 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5144 -0.7063 -1.6548 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0905 0.9436 -2.2228 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2790 1.3255 -1.6101 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6583 1.7897 -0.0983 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 5 1 0 1 11 1 0 1 12 1 0 1 13 1 0 5 14 1 0 6 15 1 0 6 16 1 0 7 17 1 0 7 18 1 0 8 19 1 0 8 20 1 0 9 21 1 0 9 22 1 0 10 23 1 0 10 24 1 0 M END