CHEMDIV-ZINC00114217 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 30 0 0 1 0 0 0 0 0999 V2000 -0.3010 1.7370 -0.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0440 0.2250 -0.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0540 -0.0820 0.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3280 -0.6060 0.0910 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0670 -1.6650 0.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2330 -0.4780 -1.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2730 0.2310 -0.9980 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0700 -0.1970 1.2930 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8200 -0.6220 2.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9540 -1.4190 2.9100 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7040 -0.0260 3.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7060 1.3710 3.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5160 1.9860 4.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3220 1.2100 5.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3210 -0.1810 5.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5110 -0.8050 4.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6140 -2.6970 4.2910 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 2.2770 -0.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0260 2.0000 -0.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6750 2.1080 0.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3600 -0.0580 -1.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8040 0.3010 1.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2300 -1.1600 0.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9970 0.3870 0.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8490 0.4250 1.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0730 1.9840 3.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5170 3.0680 4.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9550 1.6890 6.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9630 -0.7700 6.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8310 -1.0880 -2.2040 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 21 1 0 0 0 0 3 22 1 0 0 0 0 3 23 1 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 8 1 0 0 0 0 6 7 2 0 0 0 0 6 30 1 0 0 0 0 8 9 1 0 0 0 0 8 25 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 26 1 0 0 0 0 13 14 1 0 0 0 0 13 27 1 0 0 0 0 14 15 2 0 0 0 0 14 28 1 0 0 0 0 15 16 1 0 0 0 0 15 29 1 0 0 0 0 16 17 1 0 0 0 0 M CHG 1 30 -1 M END