KEGG:C08633 Pristimerin ISISHOST03240423202D 1 1.00000 0.00000 7673 35 39 0 0 0 999 V2000 0.4207 -0.5172 0.0000 C 0 0 1 0 0 0 0 0 0 0.4310 0.3069 0.0000 C 0 0 2 0 0 0 0 0 0 -0.2966 -0.9241 0.0000 C 0 0 0 0 0 0 0 0 0 1.1276 -0.9379 0.0000 C 0 0 0 0 0 0 0 0 0 0.4138 -1.3414 0.0000 C 0 0 0 0 0 0 0 0 0 1.1517 0.7138 0.0000 C 0 0 1 0 0 0 0 0 0 -0.2828 0.7276 0.0000 C 0 0 0 0 0 0 0 0 0 0.4241 1.1379 0.0000 C 0 0 0 0 0 0 0 0 0 -1.0103 -0.5069 0.0000 C 0 0 1 0 0 0 0 0 0 -0.2966 -1.7517 0.0000 C 0 0 0 0 0 0 0 0 0 1.8448 -0.5345 0.0000 C 0 0 0 0 0 0 0 0 0 1.8552 0.2897 0.0000 C 0 0 1 0 0 0 0 0 0 1.1621 1.5379 0.0000 C 0 0 0 0 0 0 0 0 0 -1.0035 0.3172 0.0000 C 0 0 0 0 0 0 0 0 0 -1.7310 -0.9172 0.0000 C 0 0 0 0 0 0 0 0 0 -1.0172 -1.3345 0.0000 C 0 0 0 0 0 0 0 0 0 -1.0172 -2.1655 0.0000 C 0 0 0 0 0 0 0 0 0 2.5724 0.6931 0.0000 C 0 0 0 0 0 0 0 0 0 2.5655 -0.1207 0.0000 C 0 0 0 0 0 0 0 0 0 1.8759 1.9345 0.0000 C 0 0 1 0 0 0 0 0 0 -1.7345 -1.7483 0.0000 C 0 0 0 0 0 0 0 0 0 -2.4448 -0.5069 0.0000 C 0 0 0 0 0 0 0 0 0 2.5862 1.5172 0.0000 C 0 0 0 0 0 0 0 0 0 2.0931 2.7414 0.0000 C 0 0 0 0 0 0 0 0 0 1.2897 2.5276 0.0000 C 0 0 0 0 0 0 0 0 0 -2.4448 -2.1621 0.0000 C 0 0 0 0 0 0 0 0 0 -3.1655 -0.9172 0.0000 C 0 0 0 0 0 0 0 0 0 2.8103 3.1586 0.0000 O 0 0 0 0 0 0 0 0 0 1.6724 3.4621 0.0000 O 0 0 0 0 0 0 0 0 0 -3.1655 -1.7483 0.0000 C 0 0 0 0 0 0 0 0 0 -2.4448 -2.9931 0.0000 C 0 0 0 0 0 0 0 0 0 -3.8862 -0.5034 0.0000 O 0 0 0 0 0 0 0 0 0 3.5207 2.7414 0.0000 C 0 0 0 0 0 0 0 0 0 -3.8862 -2.1655 0.0000 O 0 0 0 0 0 0 0 0 0 1.1448 -0.1138 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 2 8 1 6 0 0 3 9 1 0 0 0 3 10 2 0 0 0 4 11 1 0 0 0 6 12 1 0 0 0 6 13 1 0 0 0 7 14 1 0 0 0 9 15 1 0 0 0 9 16 1 1 0 0 10 17 1 0 0 0 12 18 1 0 0 0 12 19 1 1 0 0 13 20 1 0 0 0 15 21 1 0 0 0 15 22 2 0 0 0 18 23 1 0 0 0 20 24 1 6 0 0 20 25 1 1 0 0 21 26 1 0 0 0 22 27 1 0 0 0 24 28 1 0 0 0 24 29 2 0 0 0 26 30 2 0 0 0 26 31 1 0 0 0 27 32 2 0 0 0 28 33 1 0 0 0 30 34 1 0 0 0 9 14 1 0 0 0 11 12 1 0 0 0 17 21 2 0 0 0 20 23 1 0 0 0 27 30 1 0 0 0 6 35 1 1 0 0 M END