CHEMBRIDGE-ZINC00637876 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 42 0 0 1 0 0 0 0 0999 V2000 -0.1830 1.3070 -0.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0410 -0.1930 -0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0060 -0.8170 1.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1470 -2.3260 1.0830 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0500 -2.5770 1.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2230 -2.9920 -0.2280 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1620 -2.2300 -1.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2490 -2.9900 -2.8700 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -0.8980 -1.2830 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0290 -2.9020 1.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1560 -2.1300 2.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2370 -2.6550 2.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1950 -3.9550 3.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0690 -4.7330 2.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9840 -4.2060 2.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1220 -4.9680 2.0770 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1810 -4.8600 3.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0260 -6.0110 3.4490 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1790 -6.4870 4.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7760 -1.5950 3.0180 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.0750 -0.0870 2.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2560 1.1170 2.2650 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0490 -0.7240 3.4720 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1480 0.0090 4.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7990 1.7680 -0.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6200 1.6000 -1.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8300 1.6370 0.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3150 -3.9550 -0.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0100 -0.4070 -2.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1920 -1.1150 1.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0400 -4.3630 3.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4760 -3.8150 3.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8400 -5.2350 3.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0350 -5.4480 2.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0130 -7.5180 4.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3560 -5.8640 5.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0460 -6.4430 3.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2690 -1.6690 3.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -0.6440 5.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5150 0.8740 4.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1830 0.3440 4.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 9 1 0 0 0 0 3 4 1 0 0 0 0 3 21 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 10 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 20 1 0 0 0 0 13 14 2 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 38 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 M END