KEGG:C01712 (9E)-Octadecenoic acid ISISHOST03240423052D 1 1.00000 0.00000 1565 20 19 0 0 0 999 V2000 -1.0931 0.1586 0.0000 C 0 0 0 0 0 0 0 0 0 -0.4069 -0.2345 0.0000 C 0 0 0 0 0 0 0 0 0 -1.7724 -0.2345 0.0000 C 0 0 0 0 0 0 0 0 0 0.2724 0.1586 0.0000 C 0 0 0 0 0 0 0 0 0 -2.4552 0.1586 0.0000 C 0 0 0 0 0 0 0 0 0 0.9552 -0.2345 0.0000 C 0 0 0 0 0 0 0 0 0 -3.1345 -0.2345 0.0000 C 0 0 0 0 0 0 0 0 0 1.6345 0.1552 0.0000 C 0 0 0 0 0 0 0 0 0 -3.8207 0.1586 0.0000 C 0 0 0 0 0 0 0 0 0 2.3172 -0.2379 0.0000 C 0 0 0 0 0 0 0 0 0 -4.5034 -0.2345 0.0000 C 0 0 0 0 0 0 0 0 0 3.0000 0.1552 0.0000 C 0 0 0 0 0 0 0 0 0 -5.1828 0.1586 0.0000 C 0 0 0 0 0 0 0 0 0 3.6828 -0.2379 0.0000 C 0 0 0 0 0 0 0 0 0 -5.8655 -0.2379 0.0000 O 0 0 0 0 0 0 0 0 0 -5.1793 0.9483 0.0000 O 0 0 0 0 0 0 0 0 0 4.3655 0.1552 0.0000 C 0 0 0 0 0 0 0 0 0 5.0448 -0.2379 0.0000 C 0 0 0 0 0 0 0 0 0 5.7310 0.1552 0.0000 C 0 0 0 0 0 0 0 0 0 6.4103 -0.2379 0.0000 C 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 1 3 1 0 0 0 2 4 1 0 0 0 3 5 1 0 0 0 4 6 2 0 0 0 5 7 1 0 0 0 6 8 1 0 0 0 7 9 1 0 0 0 8 10 1 0 0 0 9 11 1 0 0 0 10 12 1 0 0 0 11 13 1 0 0 0 12 14 1 0 0 0 13 15 1 0 0 0 13 16 2 0 0 0 14 17 1 0 0 0 17 18 1 0 0 0 18 19 1 0 0 0 19 20 1 0 0 0 M END