KEGG:C09484 Isoalantolactone ISISHOST03240423222D 1 1.00000 0.00000 8526 20 22 0 1 0 999 V2000 -0.7276 0.5276 0.0000 C 0 0 1 0 0 0 0 0 0 -0.7310 -0.2966 0.0000 C 0 0 1 0 0 0 0 0 0 -0.0138 0.9379 0.0000 C 0 0 0 0 0 0 0 0 0 -1.4414 0.9414 0.0000 C 0 0 0 0 0 0 0 0 0 -0.7379 1.3552 0.0000 C 0 0 0 0 0 0 0 0 0 -0.0207 -0.7103 0.0000 C 0 0 0 0 0 0 0 0 0 -1.4414 -0.7103 0.0000 C 0 0 0 0 0 0 0 0 0 0.7000 0.5241 0.0000 C 0 0 2 0 0 0 0 0 0 -2.1586 0.5276 0.0000 C 0 0 0 0 0 0 0 0 0 0.6931 -0.3069 0.0000 C 0 0 1 0 0 0 0 0 0 -2.1586 -0.2966 0.0000 C 0 0 0 0 0 0 0 0 0 -1.4379 -1.5345 0.0000 C 0 0 0 0 0 0 0 0 0 1.4897 0.7724 0.0000 O 0 0 0 0 0 0 0 0 0 1.4793 -0.5690 0.0000 C 0 0 0 0 0 0 0 0 0 1.9724 0.1000 0.0000 C 0 0 0 0 0 0 0 0 0 1.7310 -1.3552 0.0000 C 0 0 0 0 0 0 0 0 0 2.7966 0.0931 0.0000 O 0 0 0 0 0 0 0 0 0 -0.7414 -1.1172 0.0000 H 0 0 0 0 0 0 0 0 0 0.6931 1.3483 0.0000 H 0 0 0 0 0 0 0 0 0 0.6897 -1.1310 0.0000 H 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 1 3 1 0 0 0 1 4 1 0 0 0 1 5 1 1 0 0 2 6 1 0 0 0 2 7 1 0 0 0 3 8 1 0 0 0 4 9 1 0 0 0 6 10 1 0 0 0 7 11 1 0 0 0 7 12 2 0 0 0 8 13 1 0 0 0 10 14 1 0 0 0 13 15 1 0 0 0 14 16 2 0 0 0 15 17 2 0 0 0 8 10 1 0 0 0 9 11 1 0 0 0 14 15 1 0 0 0 2 18 1 6 0 0 8 19 1 6 0 0 10 20 1 6 0 0 M END