KEGG:C10069 Isoathyriol ISISHOST03240423242D 1 1.00000 0.00000 9111 20 22 0 0 0 999 V2000 -0.9655 0.5241 0.0000 C 0 0 0 0 0 0 0 0 0 -0.9690 -0.3034 0.0000 C 0 0 0 0 0 0 0 0 0 -0.2483 0.9379 0.0000 O 0 0 0 0 0 0 0 0 0 -1.6828 0.9414 0.0000 C 0 0 0 0 0 0 0 0 0 -0.2552 -0.7207 0.0000 C 0 0 0 0 0 0 0 0 0 -1.6828 -0.7172 0.0000 C 0 0 0 0 0 0 0 0 0 0.4690 0.5172 0.0000 C 0 0 0 0 0 0 0 0 0 -2.4000 0.5241 0.0000 C 0 0 0 0 0 0 0 0 0 0.4621 -0.3069 0.0000 C 0 0 0 0 0 0 0 0 0 -0.2586 -1.5483 0.0000 O 0 0 0 0 0 0 0 0 0 -2.4000 -0.3034 0.0000 C 0 0 0 0 0 0 0 0 0 -1.6793 -1.5448 0.0000 O 0 0 0 0 0 0 0 0 0 1.1897 0.9276 0.0000 C 0 0 0 0 0 0 0 0 0 -3.1207 0.9414 0.0000 O 0 0 0 0 0 0 0 0 0 1.1724 -0.7276 0.0000 C 0 0 0 0 0 0 0 0 0 1.9000 0.5069 0.0000 C 0 0 0 0 0 0 0 0 0 1.8931 -0.3207 0.0000 C 0 0 0 0 0 0 0 0 0 2.6241 0.9172 0.0000 O 0 0 0 0 0 0 0 0 0 2.6103 -0.7414 0.0000 O 0 0 0 0 0 0 0 0 0 3.3379 0.4931 0.0000 C 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 1 3 1 0 0 0 1 4 1 0 0 0 2 5 1 0 0 0 2 6 1 0 0 0 3 7 1 0 0 0 4 8 2 0 0 0 5 9 1 0 0 0 5 10 2 0 0 0 6 11 2 0 0 0 6 12 1 0 0 0 7 13 1 0 0 0 8 14 1 0 0 0 9 15 1 0 0 0 13 16 2 0 0 0 15 17 2 0 0 0 16 18 1 0 0 0 17 19 1 0 0 0 18 20 1 0 0 0 7 9 2 0 0 0 8 11 1 0 0 0 16 17 1 0 0 0 M END