KEGG:C10602 Lilaline ISISHOST03240423262D 1 1.00000 0.00000 9644 30 33 0 0 0 999 V2000 -0.5897 -0.4793 0.0000 C 0 0 0 0 0 0 0 0 0 -1.3069 -0.0621 0.0000 C 0 0 0 0 0 0 0 0 0 -0.5931 -1.3069 0.0000 C 0 0 0 0 0 0 0 0 0 0.1310 -0.0655 0.0000 O 0 0 0 0 0 0 0 0 0 -1.3000 0.7690 0.0000 C 0 0 3 0 0 0 0 0 0 -2.0276 -0.4793 0.0000 C 0 0 0 0 0 0 0 0 0 0.1241 -1.7241 0.0000 C 0 0 0 0 0 0 0 0 0 -1.3069 -1.7207 0.0000 C 0 0 0 0 0 0 0 0 0 0.8448 -0.4862 0.0000 C 0 0 0 0 0 0 0 0 0 -0.6276 1.2517 0.0000 C 0 0 0 0 0 0 0 0 0 -1.9690 1.2552 0.0000 N 0 0 0 0 0 0 0 0 0 -2.0276 -1.3069 0.0000 C 0 0 0 0 0 0 0 0 0 -2.7483 -0.0621 0.0000 O 0 0 0 0 0 0 0 0 0 0.8414 -1.3138 0.0000 C 0 0 0 0 0 0 0 0 0 0.1138 -2.5483 0.0000 O 0 0 0 0 0 0 0 0 0 -1.3138 -2.5483 0.0000 O 0 0 0 0 0 0 0 0 0 1.5621 -0.0724 0.0000 C 0 0 0 0 0 0 0 0 0 -0.8862 2.0414 0.0000 C 0 0 3 0 0 0 0 0 0 -1.7138 2.0414 0.0000 C 0 0 0 0 0 0 0 0 0 1.5517 -1.7241 0.0000 O 0 0 0 0 0 0 0 0 0 2.2793 -0.4931 0.0000 C 0 0 0 0 0 0 0 0 0 1.5655 0.7552 0.0000 C 0 0 0 0 0 0 0 0 0 -0.3000 2.6345 0.0000 C 0 0 0 0 0 0 0 0 0 -2.3069 2.6379 0.0000 O 0 0 0 0 0 0 0 0 0 3.0000 -0.0793 0.0000 C 0 0 0 0 0 0 0 0 0 2.2862 1.1655 0.0000 C 0 0 0 0 0 0 0 0 0 3.0035 0.7517 0.0000 C 0 0 0 0 0 0 0 0 0 3.7138 1.1690 0.0000 O 0 0 0 0 0 0 0 0 0 -0.5862 0.3552 0.0000 H 0 0 0 0 0 0 0 0 0 -1.3069 2.7621 0.0000 H 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 1 0 0 0 2 6 2 0 0 0 3 7 1 0 0 0 3 8 1 0 0 0 4 9 1 0 0 0 5 10 1 0 0 0 5 11 1 0 0 0 6 12 1 0 0 0 6 13 1 0 0 0 7 14 1 0 0 0 7 15 2 0 0 0 8 16 1 0 0 0 9 17 1 0 0 0 10 18 1 0 0 0 11 19 1 0 0 0 14 20 1 0 0 0 17 21 2 0 0 0 17 22 1 0 0 0 18 23 1 0 0 0 19 24 2 0 0 0 21 25 1 0 0 0 22 26 2 0 0 0 25 27 2 0 0 0 27 28 1 0 0 0 8 12 2 0 0 0 9 14 2 0 0 0 18 19 1 0 0 0 26 27 1 0 0 0 5 29 1 4 0 0 18 30 1 4 0 0 M END