KEGG:C06678 4-Sulfobenzyl alcohol ISISHOST03240423152D 1 1.00000 0.00000 5741 12 12 0 0 0 999 V2000 -0.0586 -0.4379 0.0000 C 0 0 0 0 0 0 0 0 0 -0.7759 -0.0241 0.0000 C 0 0 0 0 0 0 0 0 0 0.6517 -0.0241 0.0000 C 0 0 0 0 0 0 0 0 0 -0.0586 -1.2621 0.0000 S 0 0 3 0 0 0 0 0 0 -0.7759 0.8000 0.0000 C 0 0 0 0 0 0 0 0 0 0.6517 0.8000 0.0000 C 0 0 0 0 0 0 0 0 0 -0.0552 -2.2069 0.0000 O 0 0 0 0 0 0 0 0 0 -0.7724 -1.6759 0.0000 O 0 0 0 0 0 0 0 0 0 0.6552 -1.6724 0.0000 O 0 0 0 0 0 0 0 0 0 -0.0586 1.2138 0.0000 C 0 0 0 0 0 0 0 0 0 -0.0586 2.0379 0.0000 C 0 0 0 0 0 0 0 0 0 0.6552 2.4483 0.0000 O 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 1 3 2 0 0 0 1 4 1 0 0 0 2 5 2 0 0 0 3 6 1 0 0 0 4 7 1 0 0 0 4 8 2 0 0 0 4 9 2 0 0 0 5 10 1 0 0 0 10 11 1 0 0 0 11 12 1 0 0 0 6 10 2 0 0 0 M END