KEGG:C06677 Toluene-4-sulfonate ISISHOST03240423152D 1 1.00000 0.00000 5740 11 11 0 0 0 999 V2000 0.0000 -1.0724 0.0000 S 0 0 3 0 0 0 0 0 0 0.0000 -0.2310 0.0000 C 0 0 0 0 0 0 0 0 0 0.0034 -1.8966 0.0000 O 0 0 0 0 0 0 0 0 0 -0.6966 -1.4966 0.0000 O 0 0 0 0 0 0 0 0 0 0.7034 -1.4931 0.0000 O 0 0 0 0 0 0 0 0 0 -0.7000 0.1897 0.0000 C 0 0 0 0 0 0 0 0 0 0.6966 0.1897 0.0000 C 0 0 0 0 0 0 0 0 0 -0.7000 1.0310 0.0000 C 0 0 0 0 0 0 0 0 0 0.6966 1.0310 0.0000 C 0 0 0 0 0 0 0 0 0 0.0000 1.4517 0.0000 C 0 0 0 0 0 0 0 0 0 0.0000 2.2931 0.0000 C 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 1 3 1 0 0 0 1 4 2 0 0 0 1 5 2 0 0 0 2 6 1 0 0 0 2 7 2 0 0 0 6 8 2 0 0 0 7 9 1 0 0 0 8 10 1 0 0 0 10 11 1 0 0 0 9 10 2 0 0 0 M END