CHEMDIV-ZINC04668538 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 39 0 0 0 0 0 0 0 0999 V2000 0.0240 1.4370 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0650 0.0430 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2660 -0.6110 -0.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4280 0.1160 -0.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3930 1.5110 -0.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1920 2.1620 -0.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1250 3.9350 -0.2120 S 0 0 0 0 0 0 0 0 0 0 0 0 2.3760 4.4300 -0.7510 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1430 4.3200 -0.7970 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0580 4.2850 1.4390 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1320 3.8200 2.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2000 4.7090 3.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5020 4.4320 4.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6070 5.2700 5.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3920 5.1300 6.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0890 5.3560 5.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9930 4.4930 4.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3260 3.8320 7.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2780 3.0170 7.2440 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3170 -2.5020 -0.3030 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.9130 1.9450 0.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8400 -0.5220 0.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3630 -0.3930 -0.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3000 2.0730 -0.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1150 4.3560 1.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9430 2.7790 2.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0900 3.8660 1.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2070 5.7610 3.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5670 3.3660 4.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3640 4.6550 3.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5290 5.0060 6.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 6.3250 5.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4700 5.9280 7.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2120 5.1670 6.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0320 6.4120 5.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 4.7440 3.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9210 3.4360 4.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3330 3.7510 8.1760 O 0 5 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 21 1 0 0 0 0 2 3 2 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 3 20 1 0 0 0 0 4 5 2 0 0 0 0 4 23 1 0 0 0 0 5 6 1 0 0 0 0 5 24 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 10 11 1 0 0 0 0 10 25 1 0 0 0 0 11 12 1 0 0 0 0 11 26 1 0 0 0 0 11 27 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 12 28 1 0 0 0 0 13 14 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 18 19 2 0 0 0 0 18 38 1 0 0 0 0 M CHG 1 38 -1 M END