PUBCHEM-ZINC06485195 MOE2007 3D CORINA 3.40 0006 02.08.2006 19 18 0 0 1 0 0 0 0 0999 V2000 -0.0620 1.6390 -0.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1130 -0.0820 -0.0160 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8960 -0.1730 1.1990 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1960 -0.6950 -0.1100 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0440 -0.6740 -1.3040 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4870 -0.1610 -1.4110 C 0 0 3 0 0 0 0 0 0 0 0 0 2.7470 0.5390 -0.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4210 -1.3610 -1.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7160 -2.5030 -1.9170 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7760 -2.2830 -1.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5200 0.5970 -2.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3770 0.6110 -3.3310 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9180 2.1170 -0.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.7160 -1.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6930 2.1060 0.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6270 -0.3820 -2.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3210 -1.2110 -2.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7280 -1.6010 -0.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6160 1.1180 -3.0940 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 13 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 2 3 2 0 0 0 0 2 4 2 0 0 0 0 2 5 1 0 0 0 0 5 6 1 0 0 0 0 5 16 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 11 1 0 0 0 0 8 9 1 0 0 0 0 8 17 1 0 0 0 0 8 18 1 0 0 0 0 9 10 1 0 0 0 0 11 12 2 0 0 0 0 11 19 1 0 0 0 0 M CHG 1 19 -1 M END