PUBCHEM-ZINC04372597 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 0 0 0 0 0 0999 V2000 -0.4180 1.5480 0.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3220 0.0470 0.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2960 -0.7130 1.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2080 -2.0900 1.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1460 -2.7080 0.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1720 -1.9480 -0.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2650 -0.5710 -0.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0320 -4.4630 0.1190 S 0 0 0 0 0 0 0 0 0 0 0 0 0.5550 -4.7540 -1.1420 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5180 -4.9020 1.3530 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5790 -5.0520 0.0610 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4340 -4.6720 -0.9820 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6460 -5.1340 -1.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5470 -4.7340 -2.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8520 -5.2300 -2.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6900 -4.8540 -3.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2380 -3.9850 -4.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9420 -3.4900 -4.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0980 -3.8560 -3.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0680 -3.6170 -5.2000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.1080 -2.8230 -4.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2120 -2.3820 -3.7530 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.1220 -2.4880 -5.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2010 -1.6640 -5.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1450 -1.3550 -6.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0240 -1.8580 -7.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9570 -2.6750 -8.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0020 -2.9880 -7.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8020 -3.3570 -9.9020 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.5850 1.9750 0.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9400 1.9310 -0.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9670 1.8250 1.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3450 -0.2300 2.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1880 -2.6830 2.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1230 -2.4310 -1.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2890 0.0220 -1.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8930 -5.6590 0.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9960 -5.8100 -0.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2040 -5.9060 -1.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6990 -5.2370 -3.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5940 -2.8140 -4.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0920 -3.4670 -3.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2970 -1.2710 -4.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9800 -0.7190 -6.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7660 -1.6130 -8.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1680 -3.6210 -7.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 26 27 2 0 0 0 0 26 45 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 28 46 1 0 0 0 0 M END