KEGG:C00951 Estradiol-17beta ISISHOST03240423032D 1 1.00000 0.00000 903 23 26 0 1 0 999 V2000 1.1483 0.0586 0.0000 C 0 0 1 0 0 0 0 0 0 0.4517 -0.3414 0.0000 C 0 0 1 0 0 0 0 0 0 1.1517 0.8586 0.0000 C 0 0 2 0 0 0 0 0 0 2.5310 0.0414 0.0000 C 0 0 0 0 0 0 0 0 0 -0.2414 0.0690 0.0000 C 0 0 1 0 0 0 0 0 0 0.4517 -1.1448 0.0000 C 0 0 0 0 0 0 0 0 0 0.4655 1.2655 0.0000 C 0 0 0 0 0 0 0 0 0 1.8517 1.2517 0.0000 C 0 0 2 0 0 0 0 0 0 1.1483 1.6621 0.0000 C 0 0 0 0 0 0 0 0 0 2.5414 0.8414 0.0000 C 0 0 0 0 0 0 0 0 0 -0.9414 -0.3345 0.0000 C 0 0 0 0 0 0 0 0 0 -0.2345 0.8690 0.0000 C 0 0 0 0 0 0 0 0 0 -0.2483 -1.5414 0.0000 C 0 0 0 0 0 0 0 0 0 1.8483 2.0586 0.0000 O 0 0 0 0 0 0 0 0 0 -0.9448 -1.1379 0.0000 C 0 0 0 0 0 0 0 0 0 -1.6379 0.0690 0.0000 C 0 0 0 0 0 0 0 0 0 -1.6379 -1.5379 0.0000 C 0 0 0 0 0 0 0 0 0 -2.3310 -0.3345 0.0000 C 0 0 0 0 0 0 0 0 0 -2.3345 -1.1379 0.0000 C 0 0 0 0 0 0 0 0 0 -3.0345 -1.5379 0.0000 O 0 0 0 0 0 0 0 0 0 1.1379 -0.7414 0.0000 H 0 0 0 0 0 0 0 0 0 0.4448 0.4655 0.0000 H 0 0 0 0 0 0 0 0 0 -0.2483 -0.7345 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 1 0 0 0 2 6 1 0 0 0 3 7 1 0 0 0 3 8 1 0 0 0 3 9 1 1 0 0 4 10 1 0 0 0 5 11 1 0 0 0 5 12 1 0 0 0 6 13 1 0 0 0 8 14 1 1 0 0 11 15 2 0 0 0 11 16 1 0 0 0 15 17 1 0 0 0 16 18 2 0 0 0 17 19 2 0 0 0 19 20 1 0 0 0 7 12 1 0 0 0 8 10 1 0 0 0 13 15 1 0 0 0 18 19 1 0 0 0 1 21 1 6 0 0 2 22 1 1 0 0 5 23 1 6 0 0 M END