PUBCHEM-ZINC04592013 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 36 0 0 0 0 0 0 0 0999 V2000 0.3310 1.5930 0.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 0.1450 0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4210 -0.0570 0.0360 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1700 0.2770 -1.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0730 -0.8650 -2.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4400 -1.8580 -1.8690 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6890 -0.7810 -3.3530 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5990 -1.8340 -4.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1510 -1.8550 -5.4290 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9630 -2.9390 -6.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2150 -3.8770 -5.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7380 -3.2860 -3.9860 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.0660 -0.5490 1.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4580 -0.7550 2.1440 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5140 -0.8380 1.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0290 -1.5610 -0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3810 -1.8280 -0.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2260 -1.3800 0.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7210 -0.6610 1.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3700 -0.3940 2.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0780 -1.7490 0.8020 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.4100 1.7430 0.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1070 2.2670 -0.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0950 1.8000 1.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4550 -0.0620 -0.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4670 -0.5290 0.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2160 0.4490 -0.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7520 1.1770 -1.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1950 0.0140 -3.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3800 -3.0560 -7.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9470 -4.8320 -6.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3710 -1.9110 -0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7810 -2.3870 -0.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3850 -0.3140 2.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9770 0.1630 2.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 13 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 4 28 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 29 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 34 1 0 0 0 0 20 35 1 0 0 0 0 M END