PUBCHEM-ZINC03160147 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 31 0 0 1 0 0 0 0 0999 V2000 -0.4750 1.4130 0.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2850 -0.0980 0.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4580 -0.6380 1.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6480 -2.1490 1.2860 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1510 -2.3640 0.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4850 -2.6620 2.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2530 -2.2950 3.5630 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4900 -3.5280 2.1940 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3330 -3.9170 3.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8630 -5.2030 3.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6960 -5.5910 4.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0100 -4.6900 5.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4760 -3.3980 5.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6470 -3.0160 4.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9020 -5.1020 6.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3650 -6.2250 6.4190 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1070 -3.0360 1.3090 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.4990 1.8960 0.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0040 1.7980 -0.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0560 1.6220 1.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2590 -0.5810 0.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2960 -0.3070 -0.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4320 -0.1550 1.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1230 -0.4290 2.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6270 -3.8800 1.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6200 -5.8990 2.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1070 -6.5900 4.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7160 -2.7000 6.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2380 -2.0170 4.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2030 -4.2320 7.3850 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7920 -4.5480 8.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 21 1 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 3 23 1 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 17 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 25 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 26 1 0 0 0 0 11 12 1 0 0 0 0 11 27 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 28 1 0 0 0 0 14 29 1 0 0 0 0 15 16 2 0 0 0 0 15 30 1 0 0 0 0 30 31 1 0 0 0 0 M END