PUBCHEM-ZINC00959030 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 49 0 0 1 0 0 0 0 0999 V2000 -0.0870 1.4750 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0320 -0.0310 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1240 -0.6690 1.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1790 -2.1690 1.2910 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0270 -2.4540 1.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3320 -2.7540 -0.0380 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1720 -2.0560 -1.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3710 -2.8720 -2.1870 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6620 -4.0900 -1.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6500 -4.0600 -0.4070 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1480 -0.7040 -1.1860 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0960 -2.6710 1.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3100 -2.4290 1.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4810 -2.8900 1.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4390 -3.5940 3.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2280 -3.8380 3.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0520 -3.3820 3.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1420 -3.6260 3.7100 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1120 -4.3640 4.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1410 -2.5560 1.0370 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.2420 0.1040 2.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3440 0.3730 2.7980 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8650 0.5430 2.9860 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7480 1.3790 4.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6860 2.3800 4.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5680 3.2040 5.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5180 3.0340 6.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4170 2.0390 6.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3020 1.2070 4.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9260 1.8760 -0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6340 1.8150 -0.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5950 1.8240 0.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8740 -4.9590 -2.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4390 -0.2520 -1.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3450 -1.8800 0.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3540 -3.9520 3.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1960 -4.3870 4.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1290 -4.4880 5.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4820 -3.8230 5.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3320 -5.3440 4.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7420 0.2780 2.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5060 2.5130 3.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2970 3.9820 5.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4280 3.6790 7.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2370 1.9080 6.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0310 0.4280 4.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 2 0 0 0 0 2 11 1 0 0 0 0 3 4 1 0 0 0 0 3 21 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 12 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 15 16 2 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 42 1 0 0 0 0 26 27 1 0 0 0 0 26 43 1 0 0 0 0 27 28 2 0 0 0 0 27 44 1 0 0 0 0 28 29 1 0 0 0 0 28 45 1 0 0 0 0 29 46 1 0 0 0 0 M END