PUBCHEM-ZINC02789514 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 30 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.8030 1.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 -2.0860 0.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -2.0720 -0.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -0.8210 -1.1360 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -3.1980 -1.5760 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -4.4340 -1.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 -4.5720 0.1690 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -5.6220 -1.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0830 -6.9540 -1.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0830 -7.7560 -2.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1000 -9.0870 -2.7840 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0950 -9.6190 -3.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0740 -8.7970 -5.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 -7.4500 -4.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -6.9210 -3.7110 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -5.6030 -3.2420 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0690 -9.5640 -6.8510 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8380 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8220 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8120 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -0.4750 2.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -2.9650 1.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -3.0880 -2.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0970 -7.2950 -0.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1090 -10.6930 -4.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -6.8040 -5.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 6 1 0 0 0 0 3 4 2 0 0 0 0 3 23 1 0 0 0 0 4 5 1 0 0 0 0 4 24 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 25 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 18 2 0 0 0 0 11 12 2 0 0 0 0 11 26 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 27 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 28 1 0 0 0 0 17 18 1 0 0 0 0 M END