IFLAB-ZINC04062615 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 0 0 0 0 0 0999 V2000 0.2350 0.9880 -0.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1130 -0.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -1.1460 1.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0760 -2.5870 0.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1880 -3.7330 1.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2690 -4.9680 1.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2390 -5.0700 -0.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1290 -3.9430 -1.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0460 -2.6880 -0.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0630 -1.4090 -0.9820 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1190 -1.0850 -2.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0430 -0.5260 2.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9920 -0.1200 3.0460 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3260 -0.3900 3.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3730 -0.7010 2.7700 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3240 0.0770 4.5650 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5330 0.3050 5.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6480 0.7280 4.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8420 0.9540 5.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9270 0.7590 6.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8180 0.3380 7.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6210 0.1160 6.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5630 1.0680 7.4360 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.2880 1.2660 -0.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2330 1.2730 -1.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2630 1.5000 0.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2100 -3.6560 2.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3560 -5.8600 1.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3030 -6.0420 -0.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1060 -4.0340 -2.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1580 -1.0850 -2.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4430 -1.8290 -2.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3150 -0.0990 -2.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4830 0.2540 5.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5820 0.8800 3.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7090 1.2820 4.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8880 0.1870 8.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7550 -0.2080 7.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 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 2 3 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 12 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 27 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 29 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 22 38 1 0 0 0 0 M END