PUBCHEM-ZINC04668750 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 33 0 0 1 0 0 0 0 0999 V2000 0.8430 -0.5280 -1.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1540 -0.2500 0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1860 1.2560 0.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3040 -0.7510 0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4900 -2.2750 -0.0430 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9570 -2.6900 -0.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0240 -2.4700 -0.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6460 -2.8060 0.8070 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0470 -2.9760 1.1730 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2230 -3.4430 1.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1400 -3.4010 0.5900 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4600 -4.0700 2.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4330 -5.0750 2.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7010 -5.6860 4.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0080 -5.2890 5.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 -4.2780 5.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2280 -3.6620 3.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8700 -3.7280 6.6530 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.8590 -0.1180 -1.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9270 -1.6000 -1.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2940 -0.0730 -2.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7210 -0.7420 0.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2650 1.4770 1.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 1.6260 0.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3620 1.8180 -0.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7760 -0.4120 1.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8490 -0.2480 -0.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8150 -3.1190 1.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9810 -5.3880 1.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4520 -6.4700 4.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2250 -5.7680 6.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 -2.8580 3.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4520 -2.2840 -1.4220 O 0 5 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 2 4 1 0 0 0 0 2 22 1 0 0 0 0 3 23 1 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 33 1 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 10 11 2 0 0 0 0 10 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 29 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 15 16 2 0 0 0 0 15 31 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 32 1 0 0 0 0 M CHG 1 33 -1 M END