CHEMBRIDGE-ZINC04977922 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 33 0 0 0 0 0 0 0 0999 V2000 -0.0030 1.4320 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 0.0520 -0.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1860 -0.6360 -0.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 0.0540 -0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3900 1.4530 0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1810 2.1330 0.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7140 1.8440 0.1230 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0420 2.7510 0.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4760 0.7100 0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6960 -0.3390 -0.1020 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9500 0.6730 0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6050 -0.5200 -0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0650 -0.5450 -0.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7940 -1.6360 0.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1650 -1.6550 0.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8280 -0.5940 -0.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1100 0.4920 -0.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7380 0.5190 -0.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0210 1.9310 -1.7310 Br 0 0 0 0 0 0 0 0 0 0 0 0 12.1800 -0.6180 -0.5310 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6940 1.8880 0.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2840 2.8520 0.3010 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9430 1.9620 0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 -0.4840 -0.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1820 -1.7100 -0.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 3.2080 0.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0470 -1.4450 -0.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2810 -2.4610 0.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7280 -2.4950 0.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1810 1.3600 -1.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4990 -1.0270 -1.3470 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 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 21 1 0 0 0 0 12 13 1 0 0 0 0 12 27 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 28 1 0 0 0 0 15 16 1 0 0 0 0 15 29 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 19 1 0 0 0 0 18 30 1 0 0 0 0 20 31 1 0 0 0 0 21 22 3 0 0 0 0 M END