PUBCHEM-ZINC05068953 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 37 0 0 0 0 0 0 0 0999 V2000 0.0420 -2.7480 2.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -2.0500 1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -0.6630 1.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 -0.0540 -0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 -0.7720 -1.1890 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0950 -1.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 -2.7750 0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -2.8130 -2.3520 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1030 -2.1660 -3.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1200 -0.9490 -3.5540 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2140 -2.9270 -4.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3430 -2.3940 -6.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4150 -3.4730 -6.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3290 -4.6130 -6.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2020 -4.2720 -4.8850 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3630 -5.9920 -6.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2660 -7.0790 -5.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2990 -8.3640 -6.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4280 -8.5780 -7.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5250 -7.5050 -8.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4990 -6.2150 -8.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4710 -10.3440 -8.3700 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.9820 -2.9270 2.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5650 -3.7000 2.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5540 -2.1230 3.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 -0.0680 2.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0070 1.0240 -0.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 -3.8550 0.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1070 -3.7790 -2.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3800 -1.3460 -6.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5200 -3.4150 -7.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1640 -6.9130 -4.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2230 -9.2050 -5.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6260 -7.6790 -9.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5800 -5.3790 -8.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 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 26 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 13 14 2 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 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 33 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 34 1 0 0 0 0 21 35 1 0 0 0 0 M END