KEGG:C01937 Methotrexate ISISHOST03240423052D 1 1.00000 0.00000 1761 33 35 0 1 0 999 V2000 -3.4552 0.3517 0.0000 C 0 0 0 0 0 0 0 0 0 -3.4552 1.1103 0.0000 C 0 0 0 0 0 0 0 0 0 -2.7897 -0.0310 0.0000 N 0 0 0 0 0 0 0 0 0 -4.1103 -0.0345 0.0000 C 0 0 0 0 0 0 0 0 0 -2.7966 1.4931 0.0000 N 0 0 0 0 0 0 0 0 0 -4.1103 1.4828 0.0000 N 0 0 0 0 0 0 0 0 0 -2.1276 0.3483 0.0000 C 0 0 0 0 0 0 0 0 0 -4.7621 0.3517 0.0000 N 0 0 0 0 0 0 0 0 0 -4.1138 -0.7828 0.0000 N 0 0 0 0 0 0 0 0 0 -2.1345 1.1138 0.0000 C 0 0 0 0 0 0 0 0 0 -4.7621 1.1103 0.0000 C 0 0 0 0 0 0 0 0 0 -1.4793 -0.0276 0.0000 C 0 0 0 0 0 0 0 0 0 -5.4103 1.4828 0.0000 N 0 0 0 0 0 0 0 0 0 -0.8310 0.3483 0.0000 N 0 0 3 0 0 0 0 0 0 -0.1793 -0.0241 0.0000 C 0 0 0 0 0 0 0 0 0 -0.8310 1.0966 0.0000 C 0 0 0 0 0 0 0 0 0 0.1966 0.6345 0.0000 C 0 0 0 0 0 0 0 0 0 0.2034 -0.6759 0.0000 C 0 0 0 0 0 0 0 0 0 0.9586 0.6414 0.0000 C 0 0 0 0 0 0 0 0 0 0.9552 -0.6724 0.0000 C 0 0 0 0 0 0 0 0 0 1.3310 -0.0138 0.0000 C 0 0 0 0 0 0 0 0 0 2.0793 -0.0172 0.0000 C 0 0 0 0 0 0 0 0 0 2.4552 -0.6655 0.0000 N 0 0 0 0 0 0 0 0 0 2.4552 0.6345 0.0000 O 0 0 0 0 0 0 0 0 0 3.2034 -0.6655 0.0000 C 0 0 1 0 0 0 0 0 0 3.5793 -1.3172 0.0000 C 0 0 0 0 0 0 0 0 0 3.5793 -0.0172 0.0000 C 0 0 0 0 0 0 0 0 0 4.3310 -1.3172 0.0000 C 0 0 0 0 0 0 0 0 0 4.3310 -0.0207 0.0000 O 0 0 0 0 0 0 0 0 0 3.2034 0.6310 0.0000 O 0 0 0 0 0 0 0 0 0 4.7034 -1.9655 0.0000 C 0 0 0 0 0 0 0 0 0 4.3276 -2.6138 0.0000 O 0 0 0 0 0 0 0 0 0 5.4552 -1.9655 0.0000 O 0 0 0 0 0 0 0 0 0 1 2 2 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 4 8 2 0 0 0 4 9 1 0 0 0 5 10 2 0 0 0 6 11 2 0 0 0 7 12 1 0 0 0 11 13 1 0 0 0 12 14 1 0 0 0 14 15 1 0 0 0 14 16 1 0 0 0 15 17 2 0 0 0 15 18 1 0 0 0 17 19 1 0 0 0 18 20 2 0 0 0 19 21 2 0 0 0 21 22 1 0 0 0 22 23 1 0 0 0 22 24 2 0 0 0 23 25 1 0 0 0 25 26 1 0 0 0 25 27 1 6 0 0 26 28 1 0 0 0 27 29 1 0 0 0 27 30 2 0 0 0 28 31 1 0 0 0 31 32 1 0 0 0 31 33 2 0 0 0 7 10 1 0 0 0 8 11 1 0 0 0 20 21 1 0 0 0 M END