PUBCHEM-ZINC02760847 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 -0.0210 1.5320 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 0.0020 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7340 -0.4910 1.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3740 -0.5050 -0.0010 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6430 -1.7340 -0.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7450 -2.4220 -0.9300 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0310 -2.2460 -0.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0570 -1.5360 0.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3590 -2.0600 0.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6480 -3.2100 -0.4530 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7240 -3.9580 -1.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3770 -3.5190 -1.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4120 -4.3030 -1.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7790 -5.4820 -2.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1010 -5.9160 -2.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0630 -5.1840 -1.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4470 -1.2910 0.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7500 -1.7870 0.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7580 -1.0680 1.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4780 0.1440 1.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1860 0.6410 1.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1690 -0.0730 1.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8650 1.1240 2.8180 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0020 1.9090 -0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.8820 -0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5350 1.8930 0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5140 -0.3600 -0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7490 -1.5800 1.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7570 -0.1130 1.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2200 -0.1290 2.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0910 0.0430 0.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8560 -0.5890 0.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3840 -3.9760 -1.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0340 -6.0870 -2.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3670 -6.8540 -2.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0840 -5.5350 -1.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9700 -2.7320 0.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7680 -1.4510 1.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9720 1.5870 2.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1600 0.3130 1.3920 H 0 0 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 31 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 2 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 14 15 2 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 36 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 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 40 1 0 0 0 0 M END