PUBCHEM-ZINC03074337 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 32 0 0 0 0 0 0 0 0999 V2000 0.2640 1.3270 0.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3100 -0.0530 0.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3670 -0.6940 -0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3800 0.0520 -0.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3350 1.4320 -0.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2760 2.0730 -0.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2290 3.4720 -0.0490 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3690 4.1810 0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4430 3.6110 0.0600 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3140 5.6520 0.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6420 6.4200 -0.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5940 7.7920 -0.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2100 8.4070 0.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8780 7.6520 1.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9280 6.2780 1.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6370 5.4700 2.3090 N 0 3 0 0 0 0 0 0 0 0 0 0 4.2730 6.0220 3.1890 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5850 4.2540 2.2660 O 0 5 0 0 0 0 0 0 0 0 0 0 2.1550 9.8800 0.6010 N 0 3 0 0 0 0 0 0 0 0 0 0 1.5680 10.5480 -0.2320 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6960 10.4240 1.5460 O 0 5 0 0 0 0 0 0 0 0 0 0 3.8210 -0.8220 -1.6180 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.4120 -2.0520 -0.2120 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5620 1.8250 0.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4780 -0.6340 0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1230 2.0120 -1.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3760 3.9310 -0.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1610 5.9420 -1.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 8.3880 -1.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3570 8.1380 2.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9770 -2.4380 -0.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 23 1 0 0 0 0 4 5 2 0 0 0 0 4 22 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 27 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 15 2 0 0 0 0 11 12 2 0 0 0 0 11 28 1 0 0 0 0 12 13 1 0 0 0 0 12 29 1 0 0 0 0 13 14 2 0 0 0 0 13 19 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 23 31 1 0 0 0 0 M CHG 1 16 1 M CHG 1 18 -1 M CHG 1 19 1 M CHG 1 21 -1 M END