CHEMBRIDGE-ZINC02984599 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 0 0 0 0 0 0 0 0999 V2000 0.0170 1.4670 0.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.0470 0.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4120 -0.5710 0.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4050 -2.0840 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8210 -2.6000 0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5380 -2.6640 -1.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8360 -3.1360 -1.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4200 -3.5480 0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6960 -3.4840 1.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3970 -3.0150 1.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7340 -4.0270 0.0450 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.5270 -3.8030 1.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1330 -3.1050 2.0260 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.8720 -4.4060 1.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6960 -4.1760 2.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9510 -4.7400 2.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3990 -5.5380 1.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5840 -5.7710 0.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3290 -5.2050 0.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2000 -6.8590 -1.2380 Br 0 0 0 0 0 0 0 0 0 0 0 0 -12.6370 -6.0940 1.3370 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.4220 -5.8140 2.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0410 1.8400 0.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5490 1.9480 -0.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4460 1.6910 1.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4880 -0.2710 -0.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5920 -0.5280 1.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8760 -0.3460 1.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9790 -0.0900 -0.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9420 -2.3090 -0.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8380 -2.5660 0.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0840 -2.3430 -2.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3970 -3.1850 -2.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1470 -3.8040 2.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8320 -2.9680 2.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0750 -4.5200 -0.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3480 -3.5560 3.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5870 -4.5620 3.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6970 -5.3820 -0.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9000 -6.1740 3.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.5790 -4.7390 2.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.3850 -6.3170 2.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 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 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 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 19 2 0 0 0 0 15 16 2 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 39 1 0 0 0 0 21 22 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 M END