CHEMBRIDGE-ZINC02830842 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 37 0 0 0 0 0 0 0 0999 V2000 0.5870 2.4410 1.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4710 1.0940 1.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4940 0.2020 1.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6460 0.6480 0.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7430 2.0020 0.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7210 2.8950 0.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6730 -0.3350 0.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9900 -0.1000 0.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9340 -1.1860 0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5270 -2.2730 -0.3160 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2680 -0.8020 0.2230 N 0 0 0 0 0 0 0 0 0 0 0 0 8.4740 -1.5120 -0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5400 -3.0800 -0.6010 S 0 0 0 0 0 0 0 0 0 0 0 0 9.5440 -0.6790 0.2930 N 0 0 0 0 0 0 0 0 0 0 0 0 10.9590 -0.7730 0.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6880 -1.8910 -0.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0880 -1.8760 -0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7680 -0.7410 0.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0650 0.3860 0.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6580 0.3880 0.7110 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9050 1.6290 1.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6250 1.5470 1.1160 O 0 5 0 0 0 0 0 0 0 0 0 0 15.6590 -0.7320 0.3360 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.2080 3.1360 1.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4140 0.7380 2.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3870 -0.8460 1.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6080 2.3770 -0.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 3.9440 0.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3010 -1.3140 0.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3890 0.8550 0.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4190 0.1400 0.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2810 0.2730 0.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2140 -2.8000 -0.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6310 -2.7610 -0.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5950 1.2750 1.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5810 2.6310 1.5470 O 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 26 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 6 28 1 0 0 0 0 7 8 2 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 30 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 31 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 18 19 2 0 0 0 0 18 23 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 36 2 0 0 0 0 M CHG 1 22 -1 M END