KEGG:C01984 (S)-Mandelate ISISHOST03240423052D 1 1.00000 0.00000 1800 11 11 0 1 0 999 V2000 -0.1759 -0.1000 0.0000 C 0 0 0 0 0 0 0 0 0 -0.1793 0.6517 0.0000 C 0 0 1 0 0 0 0 0 0 -0.8276 -0.4759 0.0000 C 0 0 0 0 0 0 0 0 0 0.4793 -0.4759 0.0000 C 0 0 0 0 0 0 0 0 0 0.4690 1.0276 0.0000 C 0 0 0 0 0 0 0 0 0 -0.8310 1.0241 0.0000 O 0 0 0 0 0 0 0 0 0 -0.8276 -1.2345 0.0000 C 0 0 0 0 0 0 0 0 0 0.4793 -1.2345 0.0000 C 0 0 0 0 0 0 0 0 0 1.1207 0.6552 0.0000 O 0 0 0 0 0 0 0 0 0 0.4655 1.7759 0.0000 O 0 0 0 0 0 0 0 0 0 -0.1759 -1.6172 0.0000 C 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 1 3 2 0 0 0 1 4 1 0 0 0 2 5 1 0 0 0 2 6 1 6 0 0 3 7 1 0 0 0 4 8 2 0 0 0 5 9 1 0 0 0 5 10 2 0 0 0 7 11 2 0 0 0 8 11 1 0 0 0 M END