PUBCHEM-ZINC05816727 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 34 0 0 0 0 0 0 0 0999 V2000 0.8210 1.2280 -0.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0100 -0.0090 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4120 -0.3090 1.2030 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0580 -1.5300 1.4390 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5750 -1.7940 2.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4810 -0.9740 3.5480 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2550 -3.0820 2.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7920 -3.3590 4.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4270 -4.5620 4.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5320 -5.4950 3.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0020 -5.2260 2.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3700 -4.0240 1.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4030 -7.1430 3.6900 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.3650 -0.8770 -1.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6330 -1.4600 -1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9610 -2.2720 -2.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0330 -2.5100 -3.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2280 -1.9330 -3.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5630 -1.1150 -2.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3610 -3.3110 -4.3150 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8780 0.9780 -0.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6290 1.6160 -1.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5580 1.9840 0.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1320 -2.1850 0.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7100 -2.6330 4.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8420 -4.7780 5.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0870 -5.9580 1.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -3.8140 0.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3550 -1.2760 -0.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9410 -2.7230 -2.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9470 -2.1210 -3.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5430 -0.6630 -2.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7560 -2.8410 -5.0620 H 0 0 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 2 0 0 0 0 2 14 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 24 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 25 1 0 0 0 0 9 10 1 0 0 0 0 9 26 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 27 1 0 0 0 0 12 28 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 29 1 0 0 0 0 16 17 1 0 0 0 0 16 30 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 31 1 0 0 0 0 19 32 1 0 0 0 0 20 33 1 0 0 0 0 M END