CHEMBRIDGE-ZINC04872864 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 1 0 0 0 0 0999 V2000 0.0730 1.3500 -0.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1370 0.4490 -1.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3720 -0.0860 -1.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4620 1.1070 0.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2390 1.6800 0.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6390 1.4110 0.8010 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7660 0.4760 0.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9910 1.1870 0.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1170 3.3670 1.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8720 2.6370 1.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5930 3.1190 0.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7410 2.3850 1.2350 C 0 0 3 0 0 0 0 0 0 0 0 0 8.9600 1.4360 0.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9990 3.2440 1.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0070 2.4440 1.9370 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2520 3.0000 2.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2270 2.1450 2.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5410 2.5860 2.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8790 3.8900 2.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9150 4.7520 1.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6000 4.3080 1.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6560 4.4940 2.6260 Br 0 0 0 0 0 0 0 0 0 0 0 0 8.2740 2.0520 2.5600 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0660 1.7540 3.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8770 1.7910 0.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7490 0.1690 -1.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4900 -0.8020 -2.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1550 2.3620 1.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9990 0.1220 1.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5560 -0.4210 0.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8670 0.5330 0.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8130 1.5200 -0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9500 3.7430 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3870 4.1970 1.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0350 3.3400 1.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0200 2.3790 2.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5260 4.1500 0.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6680 3.1210 -0.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3110 3.5370 0.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8060 4.1270 1.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9650 1.1260 2.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2850 1.9060 3.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1740 5.7720 1.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8770 5.0100 1.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5120 0.2210 -0.8770 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3090 2.4290 0.9550 N 0 3 0 0 0 0 0 0 0 0 0 0 6.5360 2.1160 1.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 5 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 3 27 1 0 0 0 0 3 45 2 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 4 45 1 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 8 46 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 9 46 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 11 46 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 23 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 44 1 0 0 0 0 23 24 1 0 0 0 0 46 47 1 0 0 0 0 M CHG 1 46 1 M END