PUBCHEM-ZINC00627835 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.7000 1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -2.0830 1.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0490 -2.7830 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0710 -1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6870 -1.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 -2.8810 -2.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1740 -2.5500 -3.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 -3.7200 -4.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1990 -4.7220 -3.6760 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2500 -4.2350 -2.3760 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5110 -4.9320 -1.1150 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0780 -5.9320 -1.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0980 -4.1760 -0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9980 -5.0370 -0.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6520 -4.0930 -0.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0170 -4.1890 0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7310 -5.2290 -0.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0820 -6.1740 -1.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7130 -6.0770 -1.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0730 -7.0030 -2.2330 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8730 -8.0460 -2.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9090 -2.8960 1.1290 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.1820 -3.8130 -5.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0210 -0.1570 2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -2.6150 2.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1440 -2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3770 -1.5600 -4.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5400 -4.6530 0.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0960 -3.2810 0.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7970 -5.3020 -0.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6390 -6.9870 -1.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2400 -8.7150 -3.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3530 -8.6080 -1.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6360 -7.6120 -3.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 -4.0060 -6.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4430 -4.6260 -6.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1390 -2.8750 -6.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 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 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 15 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 31 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 32 1 0 0 0 0 10 11 2 0 0 0 0 10 25 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 15 33 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 34 1 0 0 0 0 18 19 1 0 0 0 0 18 24 1 0 0 0 0 19 20 2 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 M END