PUBCHEM-ZINC05378387 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 1 0 0 0 0 0999 V2000 -0.1750 1.3730 0.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9780 2.0160 0.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2130 1.3680 0.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3070 0.0620 0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1360 -0.5720 -0.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0960 0.0810 -0.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6440 -0.6550 -0.0410 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5110 -1.6930 -0.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3510 -0.6200 1.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2700 0.1830 1.5150 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9330 -1.5290 2.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5620 -1.3780 3.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2210 -2.2010 4.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2470 -3.1820 4.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6160 -3.3440 3.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9590 -2.5200 2.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7790 -4.2990 6.0310 Br 0 0 0 0 0 0 0 0 0 0 0 0 3.9570 0.3200 -2.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7480 1.3720 -3.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2050 1.0370 -3.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1020 1.1180 -2.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1120 -0.1320 -1.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8230 -0.9350 -1.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1350 1.8790 0.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9140 3.0240 1.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0940 1.8990 0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1660 -1.5780 -0.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9970 -0.4170 -0.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3260 -0.6150 3.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7190 -2.0690 5.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8550 -4.1100 3.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4390 -2.6910 1.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9700 0.7410 -2.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8210 -0.6020 -3.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2290 1.5420 -4.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7000 2.3260 -2.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2900 0.0630 -4.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5630 1.7820 -4.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1330 1.3080 -2.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8200 1.9860 -1.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8990 -0.8070 -1.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4210 0.1600 -0.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6550 -1.5280 -2.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8930 -1.6460 -0.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6120 -0.0410 -1.1110 N 0 3 0 0 0 0 0 0 0 0 0 0 4.9420 0.8180 -0.6440 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 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 45 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 29 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 31 1 0 0 0 0 16 32 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 18 34 1 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 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 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 45 46 1 0 0 0 0 M CHG 1 45 1 M END