KEGG:C08112 Cefoperazone sodium ISISHOST03240423192D 1 1.00000 0.00000 7155 46 49 0 0 0 999 V2000 0.6069 -1.3379 0.0000 N 0 0 3 0 0 0 0 0 0 0.6103 -0.5138 0.0000 C 0 0 1 0 0 0 0 0 0 1.3207 -1.7552 0.0000 C 0 0 0 0 0 0 0 0 0 -0.2172 -1.3448 0.0000 C 0 0 0 0 0 0 0 0 0 -0.2172 -0.5138 0.0000 C 0 0 1 0 0 0 0 0 0 1.3276 -0.1034 0.0000 S 0 0 0 0 0 0 0 0 0 2.0310 -1.3483 0.0000 C 0 0 0 0 0 0 0 0 0 1.3138 -2.5828 0.0000 C 0 0 0 0 0 0 0 0 0 -0.8034 -1.9276 0.0000 O 0 0 0 0 0 0 0 0 0 -0.8069 0.0724 0.0000 N 0 0 0 0 0 0 0 0 0 2.0379 -0.5241 0.0000 C 0 0 0 0 0 0 0 0 0 2.7483 -1.7621 0.0000 C 0 0 0 0 0 0 0 0 0 2.0241 -3.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0.5966 -2.9897 0.0000 O 0 5 0 0 0 0 0 0 0 -1.6069 -0.1414 0.0000 C 0 0 0 0 0 0 0 0 0 3.4690 -1.3552 0.0000 S 0 0 0 0 0 0 0 0 0 -2.1931 0.4483 0.0000 C 0 0 1 0 0 0 0 0 0 -1.8207 -0.9414 0.0000 O 0 0 0 0 0 0 0 0 0 4.1862 -1.7724 0.0000 C 0 0 0 0 0 0 0 0 0 -2.9966 0.2276 0.0000 C 0 0 0 0 0 0 0 0 0 -1.9759 1.2448 0.0000 N 0 0 0 0 0 0 0 0 0 4.2690 -2.5966 0.0000 N 0 0 3 0 0 0 0 0 0 4.9483 -1.4414 0.0000 N 0 0 0 0 0 0 0 0 0 -3.5759 0.8172 0.0000 C 0 0 0 0 0 0 0 0 0 -3.2069 -0.5724 0.0000 C 0 0 0 0 0 0 0 0 0 -1.1759 1.4621 0.0000 C 0 0 0 0 0 0 0 0 0 5.0828 -2.7724 0.0000 N 0 0 0 0 0 0 0 0 0 3.6517 -3.1517 0.0000 C 0 0 0 0 0 0 0 0 0 5.5035 -2.0621 0.0000 N 0 0 0 0 0 0 0 0 0 -4.3759 0.6034 0.0000 C 0 0 0 0 0 0 0 0 0 -4.0069 -0.7862 0.0000 C 0 0 0 0 0 0 0 0 0 -0.9621 2.2621 0.0000 N 0 0 3 0 0 0 0 0 0 -0.5931 0.8724 0.0000 O 0 0 0 0 0 0 0 0 0 -4.5931 -0.1966 0.0000 C 0 0 0 0 0 0 0 0 0 -1.5517 2.8414 0.0000 C 0 0 0 0 0 0 0 0 0 -0.1621 2.4724 0.0000 C 0 0 0 0 0 0 0 0 0 -5.3965 -0.4172 0.0000 O 0 0 0 0 0 0 0 0 0 -1.3379 3.6448 0.0000 C 0 0 0 0 0 0 0 0 0 -2.3517 2.6276 0.0000 O 0 0 0 0 0 0 0 0 0 0.0517 3.2759 0.0000 C 0 0 0 0 0 0 0 0 0 -0.5379 3.8621 0.0000 N 0 0 3 0 0 0 0 0 0 -1.9207 4.2138 0.0000 O 0 0 0 0 0 0 0 0 0 -0.3172 4.6483 0.0000 C 0 0 0 0 0 0 0 0 0 0.4828 4.8690 0.0000 C 0 0 0 0 0 0 0 0 0 2.4414 -2.5448 0.0000 Na 0 3 0 0 0 0 0 0 0 0.6172 0.3241 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 2 0 0 0 3 8 1 0 0 0 4 9 2 0 0 0 5 10 1 1 0 0 6 11 1 0 0 0 7 12 1 0 0 0 8 13 2 0 0 0 8 14 1 0 0 0 10 15 1 0 0 0 12 16 1 0 0 0 15 17 1 0 0 0 15 18 2 0 0 0 16 19 1 0 0 0 17 20 1 1 0 0 17 21 1 0 0 0 19 22 1 0 0 0 19 23 2 0 0 0 20 24 2 0 0 0 20 25 1 0 0 0 21 26 1 0 0 0 22 27 1 0 0 0 22 28 1 0 0 0 23 29 1 0 0 0 24 30 1 0 0 0 25 31 2 0 0 0 26 32 1 0 0 0 26 33 2 0 0 0 30 34 2 0 0 0 32 35 1 0 0 0 32 36 1 0 0 0 34 37 1 0 0 0 35 38 1 0 0 0 35 39 2 0 0 0 36 40 1 0 0 0 38 41 1 0 0 0 38 42 2 0 0 0 41 43 1 0 0 0 43 44 1 0 0 0 4 5 1 0 0 0 7 11 1 0 0 0 27 29 2 0 0 0 31 34 1 0 0 0 40 41 1 0 0 0 2 46 1 6 0 0 M CHG 2 14 -1 45 1 M END