PUBCHEM-ZINC05469958 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 42 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 0.7390 -2.0270 -1.2650 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2750 -2.4160 -1.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3500 -2.5170 -2.5070 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5800 -3.9640 -2.7190 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6560 -4.4840 -2.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5740 -3.9820 -3.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5590 -2.5540 -4.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8520 -1.8210 -3.5920 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2410 -2.0740 -5.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2280 -0.7900 -6.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9460 -0.5890 -7.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5400 -1.6780 -7.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2080 -3.0660 -6.6850 S 0 0 0 0 0 0 0 0 0 0 0 0 2.1750 -4.4920 -1.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8080 -5.7200 -1.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3480 -6.2340 -0.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2490 -5.5120 0.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6240 -4.2840 0.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0850 -3.7540 -0.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5570 -2.5140 -0.1950 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2150 -7.9140 -0.2950 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 3.5700 -4.2560 -3.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2370 -4.6670 -4.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7000 0.0050 -5.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0230 0.3790 -7.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1400 -1.7020 -8.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8820 -6.2820 -2.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6640 -5.9120 1.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5500 -3.7280 1.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 23 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 17 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 11 2 0 0 0 0 10 12 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 34 1 0 0 0 0 14 15 2 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 24 1 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 M END