HMDB0034764 RDKit 3D 3-Nonen-2-one 26 25 0 0 0 0 0 0 0 0999 V2000 -3.7917 -0.5853 0.1136 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0224 0.4260 -0.6991 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7616 0.8251 0.0397 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9063 -0.4257 0.2541 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3734 -0.0595 0.9966 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1817 0.9128 0.2646 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4013 0.6637 -0.1309 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0943 -0.5726 0.0958 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5159 -0.6101 -0.4672 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7284 -1.6002 0.6674 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8193 -0.2247 1.1732 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8230 -0.7115 -0.2525 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3075 -1.5766 0.0655 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7964 0.0334 -1.7099 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6632 1.3144 -0.8462 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0231 1.2931 1.0022 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2002 1.5763 -0.5518 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5034 -1.1000 0.9018 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6276 -0.8479 -0.7127 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8192 -0.9964 1.2903 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0140 0.5072 1.9187 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7351 1.9265 0.0289 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9174 1.4986 -0.6861 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0927 -1.4356 -0.0528 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4241 -0.6009 -1.5653 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9760 0.3698 -0.1793 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 1 0 8 10 2 0 1 11 1 0 1 12 1 0 1 13 1 0 2 14 1 0 2 15 1 0 3 16 1 0 3 17 1 0 4 18 1 0 4 19 1 0 5 20 1 0 5 21 1 0 6 22 1 0 7 23 1 0 9 24 1 0 9 25 1 0 9 26 1 0 M END