PUBCHEM-ZINC06469228 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 37 0 0 1 0 0 0 0 0999 V2000 -1.4720 2.1500 1.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1600 0.7040 0.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1750 0.6140 -0.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2350 -0.8320 -0.7360 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7400 -1.2100 0.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3490 -0.9640 -1.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5540 -2.1490 -2.2170 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9310 -1.7290 -0.9920 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2240 -2.7230 -0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6510 -2.8990 1.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3690 -3.5410 -0.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9270 -4.5940 0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5210 -5.2310 1.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4290 -5.2720 2.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0970 -5.9310 3.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8610 -6.5620 3.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 -6.5240 2.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2810 -5.8680 1.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2370 -7.1590 2.8220 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9730 -2.9280 -2.0060 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.7490 -1.6660 -2.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7180 -0.6160 -3.4060 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.5640 2.6880 1.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9230 2.6730 0.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1760 2.1920 1.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7400 0.2020 1.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0970 0.1960 0.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6040 1.1150 -1.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7260 1.1860 -0.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7950 -5.0680 -0.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3990 -4.7890 2.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8050 -5.9560 4.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5980 -7.0800 4.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5770 -5.8510 0.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8020 -6.9310 2.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9320 0.1050 -2.1520 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 8 1 0 0 0 0 6 7 2 0 0 0 0 6 36 1 0 0 0 0 8 9 1 0 0 0 0 8 21 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 20 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 31 1 0 0 0 0 15 16 1 0 0 0 0 15 32 1 0 0 0 0 16 17 2 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 34 1 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 M CHG 1 36 -1 M END