PUBCHEM-ZINC05856921 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 0 0 0 0 0 0999 V2000 -0.0580 -0.5500 4.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1310 -0.9070 2.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8800 -2.0130 2.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5200 -1.3890 2.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3640 -1.4410 3.4970 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8190 -1.7610 1.3790 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0560 -2.2800 1.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1530 -1.4280 1.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4020 -1.9410 0.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5770 -3.3200 0.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4790 -4.1880 0.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2140 -3.6500 1.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8930 -5.4660 0.6950 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2300 -5.5430 0.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9500 -6.6790 0.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3060 -7.9900 0.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9110 -8.0960 0.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3150 -9.3290 0.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0930 -10.4620 0.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4730 -10.3670 0.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0860 -9.1400 0.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9720 -9.0110 0.6980 Br 0 0 0 0 0 0 0 0 0 0 0 0 -6.7600 -4.1710 0.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9180 -3.8170 0.3720 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9470 -0.2010 4.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7780 0.2380 4.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2890 -1.4310 5.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1000 -0.0260 2.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8280 -2.2680 1.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8840 -1.6650 2.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6480 -2.8950 3.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0170 -0.3610 1.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2520 -1.2790 0.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3560 -4.3020 1.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9960 -6.6200 0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3020 -7.2140 0.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2380 -9.4120 0.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6190 -11.4250 0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0720 -11.2560 0.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 28 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 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 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 10 11 2 0 0 0 0 10 23 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 23 1 0 0 0 0 15 16 1 0 0 0 0 15 35 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 36 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 19 20 2 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 23 24 2 0 0 0 0 M END