PUBCHEM-ZINC03716046 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 29 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3910 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 -0.6810 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4050 0.0300 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3860 1.4180 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1720 2.0990 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1370 3.4600 0.0040 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3440 4.1340 0.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5110 3.4820 -0.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5650 2.0990 -0.0090 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2550 -2.5720 -0.0260 Br 0 0 0 0 0 0 0 0 0 0 0 0 -1.2680 -0.7630 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5360 -1.8980 -0.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8480 -2.2890 -0.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3540 -1.4300 0.4510 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3820 -0.4620 0.7350 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4850 0.2900 1.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5070 -3.4070 -0.9270 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9180 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3490 -0.4950 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2750 5.1880 0.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5010 4.0390 1.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3490 3.5700 -1.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4450 3.9720 -0.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8580 -2.4040 -1.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0510 -3.9890 -1.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4200 -3.6000 -0.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 19 1 0 0 0 0 2 3 2 0 0 0 0 2 12 1 0 0 0 0 3 4 1 0 0 0 0 3 11 1 0 0 0 0 4 5 2 0 0 0 0 4 20 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 21 1 0 0 0 0 8 22 1 0 0 0 0 9 10 1 0 0 0 0 9 23 1 0 0 0 0 9 24 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 25 1 0 0 0 0 14 15 2 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 18 26 1 0 0 0 0 18 27 1 0 0 0 0 M END