KEGG:C07114 Benzoyl acetate ISISHOST03240423162D 1 1.00000 0.00000 6165 12 12 0 0 0 999 V2000 -0.1897 -0.4414 0.0000 C 0 0 0 0 0 0 0 0 0 -0.1690 0.3793 0.0000 C 0 0 0 0 0 0 0 0 0 0.5172 -0.8724 0.0000 C 0 0 0 0 0 0 0 0 0 -0.9172 -0.8345 0.0000 C 0 0 0 0 0 0 0 0 0 0.5552 0.7793 0.0000 C 0 0 0 0 0 0 0 0 0 -0.8759 0.8138 0.0000 O 0 0 0 0 0 0 0 0 0 0.4966 -1.6965 0.0000 C 0 0 0 0 0 0 0 0 0 -0.9345 -1.6655 0.0000 C 0 0 0 0 0 0 0 0 0 0.5759 1.6035 0.0000 C 0 0 0 0 0 0 0 0 0 -0.2310 -2.1000 0.0000 C 0 0 0 0 0 0 0 0 0 1.3035 1.9966 0.0000 O 0 0 0 0 0 0 0 0 0 -0.1276 2.0345 0.0000 O 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 2 5 1 0 0 0 2 6 2 0 0 0 3 7 2 0 0 0 4 8 1 0 0 0 5 9 1 0 0 0 7 10 1 0 0 0 9 11 1 0 0 0 9 12 2 0 0 0 8 10 2 0 0 0 M END