CHEMBRIDGE-ZINC04724939 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 1 0 0 0 0 0999 V2000 0.0180 1.5420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 0.0120 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 -0.4890 -1.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7520 -2.0190 -1.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4610 -2.5200 -2.5270 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4550 -2.0770 -2.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5830 -4.0210 -2.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0710 -4.7040 -3.3350 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2600 -4.6060 -1.4640 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2920 -6.0010 -1.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3180 -6.7850 -2.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3490 -8.1610 -2.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3530 -8.7600 -1.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3260 -7.9810 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3020 -6.6040 -0.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3950 -10.6450 -1.0070 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.6840 -2.1370 -3.7090 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1460 -1.3560 -4.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2550 -0.8650 -4.7610 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -1.1960 -5.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 -0.5210 -6.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2030 -0.5770 -7.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2810 -1.3020 -7.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1960 -1.9820 -5.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0220 -1.9360 -5.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5820 -2.5230 -3.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2530 -3.2340 -3.2250 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0420 1.9140 -0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5110 1.9020 -0.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4870 1.8990 0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5600 -0.3490 0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9930 -0.3600 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2100 -0.1280 -2.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7640 -0.1170 -1.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2820 -2.3800 -0.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2720 -2.3920 -1.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7250 -4.0590 -0.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3140 -6.3180 -3.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3700 -8.7720 -3.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3290 -8.4500 0.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2860 -5.9960 0.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8170 0.0470 -7.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2810 -0.0510 -8.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1960 -1.3380 -7.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0410 -2.5470 -5.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 17 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 37 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 38 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 15 41 1 0 0 0 0 17 18 1 0 0 0 0 17 26 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 24 2 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 M END