KEGG:C08102 Cefamandole nafate ISISHOST03240423192D 1 1.00000 0.00000 7145 35 37 0 0 0 999 V2000 0.4345 -0.3310 0.0000 N 0 0 3 0 0 0 0 0 0 0.4379 0.4897 0.0000 C 0 0 1 0 0 0 0 0 0 1.1414 -0.7448 0.0000 C 0 0 0 0 0 0 0 0 0 -0.3862 -0.3345 0.0000 C 0 0 0 0 0 0 0 0 0 -0.3862 0.4897 0.0000 C 0 0 1 0 0 0 0 0 0 1.1517 0.8966 0.0000 S 0 0 0 0 0 0 0 0 0 1.8552 -0.3379 0.0000 C 0 0 0 0 0 0 0 0 0 1.1379 -1.5690 0.0000 C 0 0 0 0 0 0 0 0 0 -0.9690 -0.9207 0.0000 O 0 0 0 0 0 0 0 0 0 -0.9724 1.0724 0.0000 N 0 0 0 0 0 0 0 0 0 1.8586 0.4828 0.0000 C 0 0 0 0 0 0 0 0 0 2.5655 -0.7552 0.0000 C 0 0 0 0 0 0 0 0 0 1.8517 -1.9862 0.0000 O 0 0 0 0 0 0 0 0 0 0.4207 -1.9793 0.0000 O 0 5 0 0 0 0 0 0 0 -1.7690 0.8586 0.0000 C 0 0 0 0 0 0 0 0 0 3.2828 -0.3448 0.0000 S 0 0 0 0 0 0 0 0 0 -2.3517 1.4448 0.0000 C 0 0 3 0 0 0 0 0 0 -1.9828 0.0621 0.0000 O 0 0 0 0 0 0 0 0 0 3.9966 -0.7621 0.0000 C 0 0 0 0 0 0 0 0 0 -3.1483 1.2310 0.0000 C 0 0 0 0 0 0 0 0 0 -2.1414 2.2483 0.0000 O 0 0 0 0 0 0 0 0 0 4.0828 -1.5828 0.0000 N 0 0 3 0 0 0 0 0 0 4.7552 -0.4310 0.0000 N 0 0 0 0 0 0 0 0 0 -3.7276 1.8138 0.0000 C 0 0 0 0 0 0 0 0 0 -3.3586 0.4345 0.0000 C 0 0 0 0 0 0 0 0 0 -2.7241 2.8276 0.0000 C 0 0 0 0 0 0 0 0 0 4.8862 -1.7586 0.0000 N 0 0 0 0 0 0 0 0 0 3.4655 -2.1345 0.0000 C 0 0 0 0 0 0 0 0 0 5.3035 -1.0483 0.0000 N 0 0 0 0 0 0 0 0 0 -4.5241 1.6000 0.0000 C 0 0 0 0 0 0 0 0 0 -4.1552 0.2207 0.0000 C 0 0 0 0 0 0 0 0 0 -3.5207 2.6138 0.0000 O 0 0 0 0 0 0 0 0 0 -4.7379 0.8034 0.0000 C 0 0 0 0 0 0 0 0 0 -1.8103 -2.5241 0.0000 Na 0 3 0 0 0 0 0 0 0 0.4897 1.3690 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 0 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 2 0 0 0 30 33 2 0 0 0 4 5 1 0 0 0 7 11 1 0 0 0 27 29 2 0 0 0 31 33 1 0 0 0 2 35 1 6 0 0 M CHG 2 14 -1 34 1 M END