PUBCHEM-ZINC04237710 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 30 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 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 0.7180 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7380 -1.9260 -1.2650 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3410 -2.5290 -2.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9040 -1.7610 -3.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5170 -2.3760 -4.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5700 -3.7570 -4.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0100 -4.5250 -3.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4010 -3.9140 -2.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7980 -4.7500 -1.2930 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9290 -4.2440 -0.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6730 -4.9450 -1.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0660 -5.9770 -2.0510 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4090 -4.5960 -5.9490 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -0.1360 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 -0.1200 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8620 -0.6840 -3.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9540 -1.7790 -5.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0530 -5.6020 -3.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3580 -6.5480 -2.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5450 -3.9720 -1.2540 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4650 -6.0580 -1.2500 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4400 -5.9590 -1.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4780 -4.1430 -1.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 2 3 1 0 0 0 0 2 19 1 0 0 0 0 2 20 1 0 0 0 0 3 4 1 0 0 0 0 3 21 1 0 0 0 0 3 22 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 23 1 0 0 0 0 7 8 1 0 0 0 0 7 24 1 0 0 0 0 8 9 2 0 0 0 0 8 15 1 0 0 0 0 9 10 1 0 0 0 0 9 25 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 28 1 0 0 0 0 13 14 2 0 0 0 0 13 27 1 0 0 0 0 26 28 1 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 M END