PUBCHEM-ZINC05526531 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6520 -0.5700 -1.1380 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1070 -0.0990 -1.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8590 -0.6520 0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3140 -0.1810 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0670 -0.7350 1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9360 -0.1290 1.1400 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.6140 -2.0740 -1.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4340 -2.6990 -0.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4690 -4.0780 -0.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5440 -4.8320 -0.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5910 -4.2070 -1.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6240 -2.8280 -1.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0380 -0.1410 -2.3570 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3750 -0.2900 -2.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4520 -0.8420 -1.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6940 -0.8360 -2.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8910 -0.2820 -3.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8500 0.2660 -4.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5670 0.2730 -3.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3740 0.7300 -4.3450 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5340 0.5090 -3.4600 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5770 -0.4580 -2.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1360 0.9910 -1.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3890 -0.2940 0.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8300 -1.7420 0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7850 -0.5400 -0.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3440 0.9080 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5960 -0.3760 2.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0370 -1.8240 1.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2260 -2.1100 0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2880 -4.5660 0.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5170 -5.9100 -0.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3820 -4.7960 -1.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4400 -2.3400 -2.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3090 -1.2760 -0.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5300 -1.2660 -1.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8780 -0.2850 -4.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0140 0.6940 -5.4560 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 1 0 0 0 0 3 4 1 0 0 0 0 3 9 1 0 0 0 0 3 15 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 12 13 2 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 23 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 20 2 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 M END