IBS-ZINC04614584 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 0 0 0 0 0 0999 V2000 -0.0130 1.0860 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 1.0910 2.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3450 1.7310 2.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5010 2.9370 3.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7500 3.5250 3.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8430 2.9060 2.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6880 1.6990 2.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4400 1.1100 1.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1100 1.1480 1.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7900 1.6530 -0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2720 1.2740 -0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3010 1.3660 2.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8190 1.7480 2.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3570 1.6450 1.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0010 2.4720 2.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3480 1.8860 3.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9400 2.6440 4.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1850 3.9900 4.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8400 4.5800 3.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2400 3.8220 2.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8940 4.4010 0.8420 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.1710 5.7960 0.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4140 1.8400 6.0700 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 1.4630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 1.4470 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0940 0.0070 2.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6030 1.3640 3.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6460 3.4210 3.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8710 4.4670 3.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8180 3.3650 2.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5420 1.2160 1.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3190 0.1650 1.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1740 0.0610 1.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6920 2.7370 -0.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3170 1.1960 -0.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7620 1.6450 -0.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3690 0.1890 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3980 0.2810 2.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8120 1.8040 3.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3680 1.3580 3.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7220 2.8330 2.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5600 0.5900 1.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7640 1.9350 0.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1570 0.8360 3.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6470 4.5800 4.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0320 5.6300 2.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8460 6.1310 -0.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2420 5.9670 0.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6350 6.3540 1.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7000 1.5600 1.2170 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9050 1.8720 1.1550 N 0 0 0 0 0 0 0 0 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 1 51 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 2 51 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 2 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 9 34 1 0 0 0 0 9 51 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 11 52 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 12 52 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 14 52 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 17 23 1 0 0 0 0 18 19 2 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 22 50 1 0 0 0 0 M END