KEGG:C10532 Sumatrol ISISHOST03240423252D 1 1.00000 0.00000 9574 33 37 0 1 0 999 V2000 0.3793 -0.4966 0.0000 C 0 0 1 0 0 0 0 0 0 1.0828 -0.9069 0.0000 C 0 0 0 0 0 0 0 0 0 -0.3207 -0.9000 0.0000 C 0 0 2 0 0 0 0 0 0 0.3828 0.3207 0.0000 C 0 0 0 0 0 0 0 0 0 1.0759 -1.7138 0.0000 C 0 0 0 0 0 0 0 0 0 1.7862 -0.5034 0.0000 C 0 0 0 0 0 0 0 0 0 -1.0276 -0.4931 0.0000 O 0 0 0 0 0 0 0 0 0 -0.3276 -1.7103 0.0000 C 0 0 0 0 0 0 0 0 0 -0.3207 0.7310 0.0000 C 0 0 0 0 0 0 0 0 0 1.0966 0.7276 0.0000 O 0 0 0 0 0 0 0 0 0 1.7724 -2.1241 0.0000 C 0 0 0 0 0 0 0 0 0 0.3759 -2.1172 0.0000 O 0 0 0 0 0 0 0 0 0 2.4793 -0.9172 0.0000 C 0 0 0 0 0 0 0 0 0 -1.0241 0.3207 0.0000 C 0 0 0 0 0 0 0 0 0 -0.3207 1.5483 0.0000 C 0 0 0 0 0 0 0 0 0 2.4759 -1.7241 0.0000 C 0 0 0 0 0 0 0 0 0 3.1931 -0.5103 0.0000 O 0 0 0 0 0 0 0 0 0 -1.7310 0.7310 0.0000 C 0 0 0 0 0 0 0 0 0 -1.0241 1.9552 0.0000 C 0 0 0 0 0 0 0 0 0 0.3862 1.9552 0.0000 O 0 0 0 0 0 0 0 0 0 3.1828 -2.1379 0.0000 O 0 0 0 0 0 0 0 0 0 3.8966 -0.9207 0.0000 C 0 0 0 0 0 0 0 0 0 -1.7276 1.5448 0.0000 C 0 0 0 0 0 0 0 0 0 -2.5103 0.4793 0.0000 C 0 0 0 0 0 0 0 0 0 3.8931 -1.7345 0.0000 C 0 0 0 0 0 0 0 0 0 -2.5035 1.7966 0.0000 O 0 0 0 0 0 0 0 0 0 -2.9828 1.1448 0.0000 C 0 0 1 0 0 0 0 0 0 -3.6276 1.7069 0.0000 C 0 0 0 0 0 0 0 0 0 -4.3897 1.4172 0.0000 C 0 0 0 0 0 0 0 0 0 -3.6276 2.5345 0.0000 C 0 0 0 0 0 0 0 0 0 1.2034 0.0586 0.0000 H 0 0 0 0 0 0 0 0 0 -1.2345 -1.4724 0.0000 H 0 0 0 0 0 0 0 0 0 -3.5034 0.5103 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 2 5 2 0 0 0 2 6 1 0 0 0 3 7 1 0 0 0 3 8 1 0 0 0 4 9 1 0 0 0 4 10 2 0 0 0 5 11 1 0 0 0 5 12 1 0 0 0 6 13 2 0 0 0 7 14 1 0 0 0 9 15 1 0 0 0 11 16 2 0 0 0 13 17 1 0 0 0 14 18 1 0 0 0 15 19 2 0 0 0 15 20 1 0 0 0 16 21 1 0 0 0 17 22 1 0 0 0 18 23 2 0 0 0 18 24 1 0 0 0 21 25 1 0 0 0 23 26 1 0 0 0 24 27 1 0 0 0 27 28 1 6 0 0 28 29 1 0 0 0 28 30 2 0 0 0 8 12 1 0 0 0 9 14 2 0 0 0 13 16 1 0 0 0 19 23 1 0 0 0 26 27 1 0 0 0 1 31 1 6 0 0 3 32 1 6 0 0 27 33 1 1 0 0 M END