PUBCHEM-ZINC03742612 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 0.5480 2.0300 -0.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3660 0.5270 -0.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0880 0.1920 0.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 -0.2790 -1.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2680 -0.1460 -2.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7030 -0.8740 -3.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -1.7700 -3.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3990 -1.9350 -2.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9360 -1.1970 -1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7190 -1.5640 -0.1320 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6100 -1.2040 0.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 -2.4830 -0.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4950 -2.7490 -1.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3050 -3.6750 -2.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5070 -4.9260 -3.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4840 -5.8400 -2.1940 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6190 -3.0360 0.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5740 -4.4150 0.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4430 -5.0030 1.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3700 -4.2200 2.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4320 -2.8480 2.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5630 -2.2560 1.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7510 -0.3840 0.8860 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.5930 2.2680 -0.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0660 2.3990 -1.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2640 2.5890 0.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9650 0.2640 0.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7750 0.4830 -0.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2120 -0.8840 0.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4010 0.7150 1.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5640 0.5420 -2.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2110 -0.7500 -4.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0940 -2.3460 -4.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6150 -3.1510 -3.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2300 -3.9770 -2.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8590 -5.0480 0.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3930 -6.0740 1.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0490 -4.6780 3.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1670 -2.2490 2.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9980 -4.9170 -4.2280 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 27 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 16 2 0 0 0 0 15 40 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 M CHG 1 40 -1 M END