KEGG:C00944 3-Dehydroquinate ISISHOST03240423032D 1 1.00000 0.00000 897 13 13 0 1 0 999 V2000 0.4379 -0.2310 0.0000 C 0 0 1 0 0 0 0 0 0 1.1517 -0.4655 0.0000 C 0 0 0 0 0 0 0 0 0 -0.2207 -0.6172 0.0000 C 0 0 0 0 0 0 0 0 0 0.4379 0.5241 0.0000 C 0 0 0 0 0 0 0 0 0 0.4138 -1.1828 0.0000 O 0 0 0 0 0 0 0 0 0 1.3035 -1.2000 0.0000 O 0 0 0 0 0 0 0 0 0 1.7069 0.0379 0.0000 O 0 0 0 0 0 0 0 0 0 -0.8690 -0.2345 0.0000 C 0 0 2 0 0 0 0 0 0 -0.2241 0.8966 0.0000 C 0 0 0 0 0 0 0 0 0 -0.8690 0.5241 0.0000 C 0 0 1 0 0 0 0 0 0 -1.5207 -0.6034 0.0000 O 0 0 0 0 0 0 0 0 0 -0.2241 1.6483 0.0000 O 0 0 0 0 0 0 0 0 0 -1.5207 0.9000 0.0000 O 0 0 0 0 0 0 0 0 0 1 2 1 1 0 0 1 3 1 0 0 0 1 4 1 0 0 0 1 5 1 6 0 0 2 6 1 0 0 0 2 7 2 0 0 0 3 8 1 0 0 0 4 9 1 0 0 0 8 10 1 0 0 0 8 11 1 1 0 0 9 12 2 0 0 0 10 13 1 6 0 0 9 10 1 0 0 0 M END