KEGG:C05143 Dhurrin ISISHOST03240423112D 1 1.00000 0.00000 4364 23 24 0 1 0 999 V2000 -0.5552 0.3483 0.0000 C 0 0 2 0 0 0 0 0 0 0.0931 0.7276 0.0000 O 0 0 0 0 0 0 0 0 0 -1.2103 0.7241 0.0000 O 0 0 0 0 0 0 0 0 0 -0.5552 -0.4103 0.0000 C 0 0 1 0 0 0 0 0 0 0.8690 1.1000 0.0000 C 0 0 1 0 0 0 0 0 0 -1.8621 0.3483 0.0000 C 0 0 1 0 0 0 0 0 0 -1.2103 -0.7931 0.0000 C 0 0 2 0 0 0 0 0 0 0.0966 -0.7828 0.0000 O 0 0 0 0 0 0 0 0 0 1.2379 0.4448 0.0000 C 0 0 0 0 0 0 0 0 0 1.4862 1.4172 0.0000 C 0 0 0 0 0 0 0 0 0 -1.8621 -0.4103 0.0000 C 0 0 2 0 0 0 0 0 0 -2.5103 0.7241 0.0000 C 0 0 0 0 0 0 0 0 0 -1.2138 -1.5414 0.0000 O 0 0 0 0 0 0 0 0 0 0.8552 -0.2034 0.0000 C 0 0 0 0 0 0 0 0 0 1.9828 0.4345 0.0000 C 0 0 0 0 0 0 0 0 0 2.1517 1.7586 0.0000 N 0 0 0 0 0 0 0 0 0 -2.5138 -0.7828 0.0000 O 0 0 0 0 0 0 0 0 0 -3.1586 0.3483 0.0000 O 0 0 0 0 0 0 0 0 0 1.2172 -0.8586 0.0000 C 0 0 0 0 0 0 0 0 0 2.3517 -0.2172 0.0000 C 0 0 0 0 0 0 0 0 0 1.9690 -0.8621 0.0000 C 0 0 0 0 0 0 0 0 0 2.3379 -1.5172 0.0000 O 0 0 0 0 0 0 0 0 0 0.5966 1.7586 0.0000 H 0 0 0 0 0 0 0 0 0 1 2 1 1 0 0 1 3 1 0 0 0 1 4 1 0 0 0 2 5 1 0 0 0 3 6 1 0 0 0 4 7 1 0 0 0 4 8 1 6 0 0 5 9 1 0 0 0 5 10 1 6 0 0 6 11 1 0 0 0 6 12 1 1 0 0 7 13 1 1 0 0 9 14 1 0 0 0 9 15 2 0 0 0 10 16 3 0 0 0 11 17 1 6 0 0 12 18 1 0 0 0 14 19 2 0 0 0 15 20 1 0 0 0 19 21 1 0 0 0 21 22 1 0 0 0 7 11 1 0 0 0 20 21 2 0 0 0 5 23 1 1 0 0 M END