PUBCHEM-ZINC05469554 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 42 0 0 0 0 0 0 0 0999 V2000 0.5810 -0.2570 0.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4190 -0.1760 -0.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3550 -2.5580 -0.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8130 -3.0190 -1.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5060 -0.6740 1.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8810 0.8120 1.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6140 1.2210 -0.0940 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0260 2.5330 -0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7520 3.3030 0.8700 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8440 2.8890 -1.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3580 4.2800 -1.1800 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7880 5.4120 -2.2870 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.1460 6.7470 -1.8570 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4070 5.0840 -2.5830 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7540 5.0230 -3.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7370 4.5560 -0.2520 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.7240 5.2380 -1.0630 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0780 3.3180 0.4240 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1530 5.6900 0.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4220 0.4150 0.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1430 0.0450 1.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9920 -1.2650 0.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7750 0.8480 -0.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 -0.4810 -1.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3130 -3.0540 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6720 -2.7800 0.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4470 -2.6810 -2.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2050 -2.6580 -1.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7760 -4.1130 -1.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9690 -0.9810 1.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4190 -1.2720 0.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5190 0.9600 1.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9890 1.4370 1.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2090 2.7570 -2.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6790 2.1880 -1.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8100 5.2040 -3.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4210 5.6780 -4.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5810 3.9820 -4.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8670 6.6360 0.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9760 5.8640 1.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3150 5.2430 1.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6380 -1.0540 -0.1870 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.2440 -0.8770 -1.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 23 1 0 0 0 0 2 24 1 0 0 0 0 2 42 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 3 26 1 0 0 0 0 3 42 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 5 42 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 2 0 0 0 0 12 14 2 0 0 0 0 12 15 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 17 2 0 0 0 0 16 18 2 0 0 0 0 16 19 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 42 43 1 0 0 0 0 M CHG 1 42 1 M END