NIH-ZINC02840725 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 0 0 0 0 0999 V2000 0.0860 1.5540 0.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0730 0.1630 0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0080 -0.6660 -0.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2520 -0.0800 -0.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4150 1.3090 -0.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3320 2.1410 -0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5030 3.6350 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2640 5.6920 1.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0790 6.1910 2.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2380 5.7740 3.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4560 4.2660 3.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6350 3.7680 2.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9290 -2.0720 -0.2850 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1750 -2.8790 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2950 -2.4840 0.2500 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1270 -4.2870 -0.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6680 -5.4120 -0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1600 -6.5300 -0.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4010 -6.0120 -0.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4040 -4.6600 -0.5560 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9310 -7.0290 -1.0770 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.7840 2.1660 0.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0610 -0.2380 0.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1140 -0.6960 -0.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3980 1.7270 -0.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4540 3.9610 -0.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6940 4.1110 -0.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3740 5.9140 0.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1470 6.1320 0.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9900 7.2830 2.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1410 5.7960 3.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1530 6.2870 3.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0410 6.0850 4.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3390 4.0020 4.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6000 3.7580 4.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5350 4.1830 1.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6870 2.6750 2.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7810 -2.5720 -0.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7190 -5.4190 0.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1210 -7.5730 -0.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4470 4.1900 1.3720 N 0 3 0 0 0 0 0 0 0 0 0 0 0.6110 3.7790 1.8070 H 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 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 13 1 0 0 0 0 4 5 2 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 7 26 1 0 0 0 0 7 27 1 0 0 0 0 7 41 1 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 41 42 1 0 0 0 0 M CHG 1 41 1 M END