PUBCHEM-ZINC05027933 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 30 0 0 1 0 0 0 0 0999 V2000 -0.0220 1.8100 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.7600 -0.4360 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9120 -1.9590 0.0100 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3690 -2.3740 -0.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3710 -2.3170 -0.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9020 -2.9660 0.7680 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3670 -2.5090 1.2540 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5990 -3.9760 1.2430 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.1630 -4.2100 2.5750 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4480 -4.8690 0.5350 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8570 -3.7960 0.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0440 -3.4090 0.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1860 -3.2680 0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1420 -3.5130 -1.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9540 -3.9000 -1.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8140 -4.0460 -1.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7050 -3.3200 -2.3110 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 2.1870 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 2.1710 -0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 2.1610 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2260 -0.0280 0.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2430 -0.0190 -0.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4570 -2.0140 2.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0780 -3.2170 1.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1130 -2.9660 0.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9190 -4.0910 -2.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1130 -4.3520 -1.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0810 -1.9160 -1.1680 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0130 -2.1700 -1.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 3 23 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 29 1 0 0 0 0 8 9 1 0 0 0 0 8 24 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 25 1 0 0 0 0 14 15 1 0 0 0 0 14 26 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 27 1 0 0 0 0 17 28 1 0 0 0 0 29 30 1 0 0 0 0 M END