PUBCHEM-ZINC05577154 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 28 0 0 0 0 0 0 0 0999 V2000 -0.0850 1.3960 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2510 -0.0290 0.0070 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2920 -0.8370 1.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -0.4730 2.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0560 -1.4960 3.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4580 -1.2370 4.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3730 -2.1990 5.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2200 -3.4270 5.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7310 -3.6890 4.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6570 -2.7310 3.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5350 -5.3610 3.8320 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.3010 -4.3720 6.4360 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0660 -1.8520 7.4640 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.6790 -2.1710 0.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8320 -3.1830 1.3180 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8280 -2.0500 -0.6730 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5770 -0.8160 -1.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6390 -0.3790 -2.3500 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8220 1.9870 0.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.6300 -0.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7830 1.6300 0.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1120 0.5680 2.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9190 -0.2840 4.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0590 -2.9340 2.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1080 -4.3230 6.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4440 0.5480 -2.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8790 -0.9960 -3.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 17 1 0 0 0 0 3 4 2 0 0 0 0 3 14 1 0 0 0 0 4 5 1 0 0 0 0 4 22 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 23 1 0 0 0 0 7 8 1 0 0 0 0 7 13 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 24 1 0 0 0 0 12 25 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 18 26 1 0 0 0 0 18 27 1 0 0 0 0 M END