IBS-ZINC04464492 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 0 0 0 0 0 0999 V2000 -0.5560 1.4970 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4500 -0.0060 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3880 -0.6900 1.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2900 -2.0700 1.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2590 -2.7230 -0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3260 -1.9600 -1.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4240 -0.6480 -1.1490 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1550 -4.1960 -0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0190 -4.8450 0.9040 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2100 -4.8190 -1.3100 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2270 -6.2190 -1.3690 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1670 -6.8220 -2.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1730 -6.0400 -3.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2490 -6.5480 -5.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2240 -5.4530 -5.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1350 -4.3300 -5.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1100 -4.6950 -3.8450 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0800 -2.9440 -5.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1390 -1.8840 -4.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1890 -0.5910 -5.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.3420 -6.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1950 -1.3870 -7.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2410 -2.6870 -7.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4220 -1.0350 -9.3160 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.4430 1.9320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1050 1.8270 -0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0840 1.8200 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4140 -0.1520 2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2390 -2.6290 2.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3030 -2.4500 -2.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2390 -4.2990 -2.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1120 -7.9000 -2.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3140 -7.5900 -5.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2670 -5.4900 -6.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2680 -2.0760 -3.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3590 0.2290 -4.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0630 0.6720 -6.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4060 -3.5020 -7.6980 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 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 15 16 2 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 21 22 2 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 38 1 0 0 0 0 M END