KEGG:C07063 Labetalol ISISHOST03240423162D 1 1.00000 0.00000 6115 24 25 0 0 0 999 V2000 1.8483 -0.1690 0.0000 C 0 0 0 0 0 0 0 0 0 1.8483 0.6552 0.0000 C 0 0 0 0 0 0 0 0 0 2.5655 -0.5828 0.0000 C 0 0 0 0 0 0 0 0 0 1.1345 -0.5828 0.0000 C 0 0 3 0 0 0 0 0 0 2.5655 1.0690 0.0000 C 0 0 0 0 0 0 0 0 0 3.2759 -0.1690 0.0000 C 0 0 0 0 0 0 0 0 0 0.4207 -0.1690 0.0000 C 0 0 0 0 0 0 0 0 0 1.1345 -1.4069 0.0000 O 0 0 0 0 0 0 0 0 0 3.2759 0.6552 0.0000 C 0 0 0 0 0 0 0 0 0 2.5552 1.8966 0.0000 C 0 0 0 0 0 0 0 0 0 -0.2931 -0.5828 0.0000 N 0 0 0 0 0 0 0 0 0 3.9862 1.0724 0.0000 O 0 0 0 0 0 0 0 0 0 3.2690 2.3103 0.0000 N 0 0 0 0 0 0 0 0 0 1.8414 2.3069 0.0000 O 0 0 0 0 0 0 0 0 0 -1.0103 -0.1724 0.0000 C 0 0 3 0 0 0 0 0 0 -1.7241 -0.5862 0.0000 C 0 0 0 0 0 0 0 0 0 -1.0103 0.6517 0.0000 C 0 0 0 0 0 0 0 0 0 -2.4379 -0.1724 0.0000 C 0 0 0 0 0 0 0 0 0 -3.1586 -0.5897 0.0000 C 0 0 0 0 0 0 0 0 0 -3.1586 -1.4207 0.0000 C 0 0 0 0 0 0 0 0 0 -3.8724 -0.1724 0.0000 C 0 0 0 0 0 0 0 0 0 -3.8724 -1.8310 0.0000 C 0 0 0 0 0 0 0 0 0 -4.5931 -0.5897 0.0000 C 0 0 0 0 0 0 0 0 0 -4.5931 -1.4207 0.0000 C 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 1 3 1 0 0 0 1 4 1 0 0 0 2 5 1 0 0 0 3 6 2 0 0 0 4 7 1 0 0 0 4 8 1 0 0 0 5 9 2 0 0 0 5 10 1 0 0 0 7 11 1 0 0 0 9 12 1 0 0 0 10 13 1 0 0 0 10 14 2 0 0 0 11 15 1 0 0 0 15 16 1 0 0 0 15 17 1 0 0 0 16 18 1 0 0 0 18 19 1 0 0 0 19 20 1 0 0 0 19 21 2 0 0 0 20 22 2 0 0 0 21 23 1 0 0 0 22 24 1 0 0 0 6 9 1 0 0 0 23 24 2 0 0 0 M END