CHEMBRIDGE-ZINC05028013 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 38 0 0 0 0 0 0 0 0999 V2000 3.7780 0.8950 -0.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1870 -0.4800 -0.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2290 -1.0940 0.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6930 -2.3520 0.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1080 -3.0090 -0.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0650 -2.3870 -1.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6100 -1.1080 -1.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4460 -3.2440 -2.5860 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1090 -4.3360 -1.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4980 -4.2390 -0.6310 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3690 -4.9090 0.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4170 -5.4940 -2.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0640 -5.4180 -3.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0880 -4.1300 -4.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3120 -4.0510 -5.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2880 -2.8390 -6.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1330 -1.6950 -5.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5320 -1.7670 -4.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5170 -2.9750 -3.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1030 -0.2050 -3.6060 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.7110 -2.7530 -7.9210 N 0 3 0 0 0 0 0 0 0 0 0 0 1.0810 -3.7550 -8.5080 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6900 -1.6820 -8.4990 O 0 5 0 0 0 0 0 0 0 0 0 0 0.2490 -6.6960 -1.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1160 -7.6500 -1.1770 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8270 0.8070 -1.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2360 1.4270 -1.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6960 1.4460 -0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6850 -0.5820 1.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7290 -2.8250 1.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5780 -0.6190 -2.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4280 -6.3080 -4.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6400 -4.9380 -6.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8310 -3.0310 -2.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1550 -0.5020 -6.4850 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9910 -0.3120 -6.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 12 13 2 0 0 0 0 12 24 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 17 18 2 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 34 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 24 25 3 0 0 0 0 35 36 1 0 0 0 0 M CHG 1 21 1 M CHG 1 23 -1 M END