CHEMBRIDGE-ZINC02975327 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 35 0 0 1 0 0 0 0 0999 V2000 -0.0200 1.5200 0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 -0.0100 -0.0010 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5130 -0.3540 -0.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4090 -0.5340 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7840 -1.2460 0.9100 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2510 -0.2100 -0.9860 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5970 -0.7510 -0.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3920 -0.2840 -2.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8760 0.4350 -2.9330 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6770 -0.6640 -2.2470 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4440 -0.1530 -3.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8540 0.1030 -4.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6130 0.6070 -5.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9610 0.8570 -5.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5520 0.6040 -4.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7990 0.0940 -3.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9980 1.5480 -6.8060 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.7150 -0.5020 1.1820 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0580 -0.6100 1.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6780 -0.2990 0.1690 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7900 -1.1160 2.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0020 1.8990 0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5490 1.8860 -0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8640 0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5510 -1.8400 -0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0770 -0.4060 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0700 -1.2910 -1.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8020 -0.0920 -4.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1540 0.8060 -6.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6040 0.8010 -4.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2620 -0.1080 -2.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2190 -0.7500 1.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4480 -2.1240 2.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8610 -1.1340 2.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5890 -0.4570 3.2250 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 4 1 0 0 0 0 2 18 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 25 1 0 0 0 0 7 26 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 27 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 28 1 0 0 0 0 13 14 1 0 0 0 0 13 29 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 30 1 0 0 0 0 16 31 1 0 0 0 0 18 19 1 0 0 0 0 18 32 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 33 1 0 0 0 0 21 34 1 0 0 0 0 21 35 1 0 0 0 0 M END