PUBCHEM-ZINC05531450 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 1 0 0 0 0 0999 V2000 -0.2530 1.4920 -0.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 -0.0130 0.0050 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9500 -0.5360 0.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8610 -0.2950 1.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9770 -0.7470 1.0670 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3890 -0.0450 2.4480 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1880 -0.3080 3.5680 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7320 -0.0670 4.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5720 -0.3430 5.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2350 -0.1440 7.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2700 -0.5180 8.0460 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2660 -0.4680 9.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3250 -0.9760 7.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9380 -0.8940 5.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8150 -1.3000 4.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0600 -1.7850 5.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4420 -1.8690 6.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5880 -1.4640 7.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6710 -0.4650 -1.1740 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1070 -0.7750 -2.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4730 -0.5410 -2.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2610 -0.8560 -3.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6900 -1.4050 -4.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3280 -1.6400 -4.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4660 -1.3210 -3.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3300 -1.6350 -3.4500 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.6980 2.0150 -0.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8740 1.6970 -0.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7640 1.8370 0.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5040 0.3160 2.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2610 0.3360 4.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2910 0.2500 7.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5210 -1.2360 3.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7420 -2.1010 4.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4200 -2.2500 6.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8940 -1.5350 8.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9210 -0.1120 -1.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3250 -0.6740 -3.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3080 -1.6510 -5.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1160 -2.0700 -5.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 19 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 10 2 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 16 17 2 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 23 24 2 0 0 0 0 23 39 1 0 0 0 0 24 25 1 0 0 0 0 24 40 1 0 0 0 0 25 26 1 0 0 0 0 M END