CHEMBRIDGE-ZINC00947098 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 0 0 0 0 0 0999 V2000 0.4250 1.4820 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4220 -0.0260 -0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2590 -0.7100 1.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2550 -2.0910 1.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4160 -2.7920 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5800 -2.1040 -1.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5770 -0.7210 -1.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8000 -3.0550 -2.8500 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.4130 -4.1520 -0.0300 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2400 -4.7940 1.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2640 -6.2880 1.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4150 -6.7580 -0.0610 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1190 -7.1040 2.1110 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 -8.4880 1.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5530 -9.3530 2.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4680 -10.7210 2.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1360 -11.2380 1.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6650 -10.3780 0.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5840 -8.9960 0.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3130 -10.9280 -0.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7720 -10.1780 -1.4390 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3950 -12.2610 -0.7740 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0450 -12.7310 -1.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4440 1.8440 0.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 1.8410 -1.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2040 1.8500 0.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1340 -0.1640 2.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1280 -2.6250 2.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7000 -0.1840 -2.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0480 -4.4990 1.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7160 -4.4970 1.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0750 -6.7310 3.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0280 -8.9540 3.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8770 -11.3870 3.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2000 -12.3070 1.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9950 -8.3260 0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5070 -12.3550 -2.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0430 -13.8210 -1.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0730 -12.3690 -2.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 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 27 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 29 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 12 2 0 0 0 0 11 13 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 34 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 36 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 M END