PUBCHEM-ZINC02543165 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 0 0 0 0 0 0999 V2000 -0.7310 -0.5920 -0.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7950 -0.5760 -0.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2090 -1.1780 0.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6330 -1.1630 0.7640 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1680 -1.6660 1.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5480 -1.6800 2.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0950 -2.1900 3.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2610 -2.6920 4.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8740 -2.6740 4.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3350 -2.1590 2.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8420 -3.2390 5.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0480 -3.3260 5.5940 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0360 -3.6410 6.4780 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6290 -4.2330 7.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7540 -5.6120 7.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3580 -6.2130 8.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8430 -5.4440 9.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7260 -4.0700 9.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1220 -3.4500 8.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9990 -1.9830 8.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4740 -1.4080 7.5140 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4610 -0.0100 7.4180 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8420 0.5880 6.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2120 -0.0780 5.5820 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9270 2.0520 6.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2850 2.6750 5.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3670 4.0410 4.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0870 4.8010 5.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7280 4.1850 6.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6460 2.8200 7.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1660 6.1470 5.7550 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6660 -6.2820 11.2130 Br 0 0 0 0 0 0 0 0 0 0 0 0 -1.1640 -0.0050 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0260 -0.1630 -1.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0890 -1.6190 -0.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2280 -1.1620 -1.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1530 0.4520 -0.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7750 -0.5910 1.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8500 -2.2050 0.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1920 -1.2920 1.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1670 -2.2020 3.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2260 -3.0620 4.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2640 -2.1420 2.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3790 -6.2180 6.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4530 -7.2880 8.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1050 -3.4740 10.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3460 -1.3850 9.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8990 0.5260 8.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7260 2.0850 4.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8710 4.5230 4.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2870 4.7790 7.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1400 2.3430 7.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4620 6.6350 6.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 38 1 0 0 0 0 3 39 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 40 1 0 0 0 0 7 8 1 0 0 0 0 7 41 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 42 1 0 0 0 0 10 43 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 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 44 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 17 18 2 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 28 29 2 0 0 0 0 28 31 1 0 0 0 0 29 30 1 0 0 0 0 29 51 1 0 0 0 0 30 52 1 0 0 0 0 31 53 1 0 0 0 0 M END