PUBCHEM-ZINC05905683 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 37 0 0 0 0 0 0 0 0999 V2000 0.3180 1.1900 0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3440 0.2440 1.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6690 -0.6100 1.5770 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2180 -1.5150 2.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 -1.6250 2.8240 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2740 -2.3610 3.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6890 -2.3930 2.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3670 -3.3360 3.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3340 -4.1560 4.5610 S 0 0 0 0 0 0 0 0 0 0 0 0 0.9790 -3.2830 4.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2770 -3.4990 4.6120 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6230 -4.3970 5.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1220 -5.1570 6.2240 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1210 -4.4200 5.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6800 -2.8220 6.5260 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.4460 -3.2260 6.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1090 -1.9630 7.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1620 -1.8890 8.5400 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8200 -3.6850 3.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3460 -1.5310 1.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8170 0.6300 -0.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4160 1.8660 -0.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0900 1.7860 0.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8190 0.8180 1.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0970 -0.3600 0.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -2.9060 4.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6400 -4.6430 4.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3420 -5.2100 6.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8820 -3.4930 5.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5690 -4.0610 7.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4260 -2.7990 3.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0820 -4.4540 4.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0980 -4.0610 2.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2590 -0.4750 1.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4120 -1.7540 1.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8820 -1.6890 0.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5890 -1.1750 6.4100 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 10 2 0 0 0 0 7 8 2 0 0 0 0 7 20 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 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 26 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 27 1 0 0 0 0 14 28 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 29 1 0 0 0 0 16 30 1 0 0 0 0 17 18 2 0 0 0 0 17 37 1 0 0 0 0 19 31 1 0 0 0 0 19 32 1 0 0 0 0 19 33 1 0 0 0 0 20 34 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 M CHG 1 37 -1 M END