PUBCHEM-ZINC05500686 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 41 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0600 -0.5960 -0.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1560 -0.6940 0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1360 -2.1590 0.0010 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1580 -2.5360 0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4200 -2.6520 -1.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2150 -2.2570 -2.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1560 -1.0710 -3.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0090 -1.1090 -4.1490 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6090 -2.2830 -4.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1260 -3.0310 -3.1350 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3840 -3.9380 -2.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5420 -2.6820 -5.0760 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9120 -1.8820 -6.0170 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8500 -2.2840 -6.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2540 -1.4190 -7.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2010 -1.8310 -8.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7530 -3.0980 -8.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3580 -3.9600 -7.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4070 -3.5640 -6.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0520 -3.6540 -10.0220 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.4070 -2.6580 1.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3470 -1.9250 1.8170 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5960 -3.9160 1.6490 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1390 -4.3290 2.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0020 -0.2200 0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5720 -2.2040 -1.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3260 -3.7370 -1.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5270 -0.2360 -2.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8250 -0.4300 -8.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5140 -1.1640 -9.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7930 -4.9460 -7.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0960 -4.2380 -6.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1360 -3.6910 3.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1040 -5.3650 3.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2090 -4.2410 2.6430 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 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 23 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 2 0 0 0 0 8 12 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 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 14 15 2 0 0 0 0 15 16 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 34 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 21 37 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 26 38 1 0 0 0 0 26 39 1 0 0 0 0 26 40 1 0 0 0 0 M END