PUBCHEM-ZINC04668599 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 22 0 0 1 0 0 0 0 0999 V2000 0.1520 1.4820 0.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 0.0780 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 -0.6020 0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5020 0.4780 0.3850 S 0 0 0 0 0 0 0 0 0 0 0 0 1.4630 1.8340 0.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4020 -2.0400 -0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4720 -2.8100 -0.3010 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6950 -2.4820 0.0680 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1680 -3.8760 -0.0040 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4920 -4.5040 0.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3200 -4.3800 -1.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7570 -5.0000 -2.1560 S 0 0 0 0 0 0 0 0 0 0 0 0 0.9560 -4.0800 -1.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6040 -3.9790 0.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1950 -2.8610 0.6880 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6610 2.1950 0.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9390 -0.4180 -0.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8640 2.8220 0.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4510 -1.8220 0.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6820 -3.5760 -2.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0350 -5.2060 -1.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9940 -5.1390 0.8830 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 16 1 0 0 0 0 2 3 2 0 0 0 0 2 17 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 5 18 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 19 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 14 1 0 0 0 0 11 12 1 0 0 0 0 11 20 1 0 0 0 0 11 21 1 0 0 0 0 12 13 1 0 0 0 0 14 15 2 0 0 0 0 14 22 1 0 0 0 0 M CHG 1 22 -1 M END