KEGG:C10472 Isosafrole ISISHOST03240423252D 1 1.00000 0.00000 9514 12 13 0 0 0 999 V2000 -0.8414 0.2414 0.0000 C 0 0 0 0 0 0 0 0 0 -0.8379 -0.5897 0.0000 C 0 0 0 0 0 0 0 0 0 -0.1172 0.6586 0.0000 C 0 0 0 0 0 0 0 0 0 -1.6310 0.4966 0.0000 O 0 0 0 0 0 0 0 0 0 -0.1172 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 -1.6276 -0.8448 0.0000 O 0 0 0 0 0 0 0 0 0 0.6000 0.2414 0.0000 C 0 0 0 0 0 0 0 0 0 -2.1138 -0.1759 0.0000 C 0 0 0 0 0 0 0 0 0 0.6000 -0.5897 0.0000 C 0 0 0 0 0 0 0 0 0 1.3103 0.6586 0.0000 C 0 0 0 0 0 0 0 0 0 2.0276 0.2448 0.0000 C 0 0 0 0 0 0 0 0 0 2.7448 0.6621 0.0000 C 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 1 3 2 0 0 0 1 4 1 0 0 0 2 5 2 0 0 0 2 6 1 0 0 0 3 7 1 0 0 0 4 8 1 0 0 0 5 9 1 0 0 0 7 10 1 0 0 0 10 11 2 0 0 0 11 12 1 0 0 0 6 8 1 0 0 0 7 9 2 0 0 0 M END