PUBCHEM-ZINC04409440 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 0 0 0 0 0 0999 V2000 0.5670 0.7300 0.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8200 -0.6890 0.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6780 -2.1960 -1.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6130 -2.2500 -3.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7560 -1.5480 -3.6720 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0130 -0.1840 -3.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0980 -0.1400 -1.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5160 -2.1290 -4.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8970 -1.9100 -4.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6640 -2.5000 -5.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0710 -3.3320 -6.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7020 -3.5650 -6.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9420 -2.9720 -5.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9090 -3.8840 -7.7280 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5660 -4.7330 -8.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4400 -5.1580 -9.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7080 -5.0880 -9.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8170 -5.8970 -10.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1800 -5.8800 -11.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8090 -5.0640 -10.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9400 -4.5760 -9.2690 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6530 -4.6550 -10.1890 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 1.3950 0.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3410 1.1440 0.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4380 0.7430 2.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7700 -1.0850 0.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 -1.3340 0.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2490 -2.5850 -1.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5330 -2.7640 -1.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5790 -3.3070 -3.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3150 -1.7830 -3.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9220 0.2560 -3.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1860 0.4550 -3.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9560 -0.7090 -1.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1620 0.8960 -1.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4170 -1.2950 -4.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7320 -2.2970 -5.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1830 -4.1960 -7.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8720 -3.1620 -5.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8930 -3.6350 -7.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0030 -6.4300 -11.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6350 -6.3980 -11.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8440 -0.7580 -1.0530 N 0 3 0 0 0 0 0 0 0 0 0 0 0.0330 -0.2310 -1.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 2 43 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 3 43 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 6 33 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 7 43 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 17 21 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 22 1 0 0 0 0 43 44 1 0 0 0 0 M CHG 1 43 1 M END