PUBCHEM-ZINC03736608 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 49 0 0 1 0 0 0 0 0999 V2000 1.2180 1.3220 0.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4870 -0.0010 0.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5320 -0.7850 1.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1040 -2.0470 1.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8080 -2.5000 0.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8980 -1.7130 -0.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2780 -0.4510 -0.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4100 0.3620 -2.1360 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1030 1.4010 -1.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7940 0.4200 -2.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1260 0.2860 -4.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5350 0.4360 -4.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4470 0.3940 -5.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8070 0.5930 -4.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2700 0.8310 -3.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3810 0.8780 -2.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0220 0.6760 -2.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9430 0.6710 -2.0050 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0100 0.8270 -1.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0400 0.5390 -6.4030 Br 0 0 0 0 0 0 0 0 0 0 0 0 -1.0970 0.0250 -5.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3070 0.3940 -4.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -2.7570 2.6480 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6440 -4.0050 2.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2850 -0.2940 2.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7240 1.4390 -0.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5130 2.1450 0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0120 1.4070 0.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3080 -3.4640 0.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4740 -2.1050 -1.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0950 0.2090 -6.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3310 0.9850 -3.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7410 1.0640 -1.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1230 -1.0390 -5.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3140 0.5970 -5.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0860 -0.0200 -5.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4430 1.4780 -4.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4490 -4.4070 3.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7270 -3.8790 2.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2570 -4.7250 2.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0340 0.7510 2.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0340 -0.8470 3.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3630 -0.3890 2.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5330 -0.1750 -3.1960 N 0 3 0 0 0 0 0 0 0 0 0 0 1.4990 -0.0050 -2.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4210 -1.1960 -3.2300 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 25 1 0 0 0 0 4 5 1 0 0 0 0 4 23 1 0 0 0 0 5 6 2 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 44 1 0 0 0 0 10 11 2 0 0 0 0 10 18 1 0 0 0 0 11 12 1 0 0 0 0 11 21 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 31 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 32 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 21 22 1 0 0 0 0 21 34 1 0 0 0 0 21 35 1 0 0 0 0 22 36 1 0 0 0 0 22 37 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 24 38 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 44 45 1 0 0 0 0 44 46 1 0 0 0 0 M CHG 1 44 1 M END