IBS-ZINC04228014 MOE2007 3D CORINA 3.40 0006 02.08.2006 26 27 0 0 0 0 0 0 0 0999 V2000 0.1340 1.5130 0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 0.0200 0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0310 -0.7020 1.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1510 -2.1140 1.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2320 -2.8050 0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2010 -2.0500 -1.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0980 -0.6610 -1.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2790 -2.8500 -2.1910 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3540 -4.1200 -1.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3390 -4.1810 -0.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4180 -5.4080 0.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9670 -5.8540 0.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7620 -6.2230 0.0470 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4770 -5.5880 -2.9320 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.1290 -2.7850 2.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1950 1.7770 0.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3140 1.9660 -0.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3690 1.9450 0.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -0.1550 2.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0720 -0.1450 -2.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0770 -5.2350 1.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8740 -6.2410 -0.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9040 -3.5520 2.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8530 -3.2290 2.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3270 -2.0690 3.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1400 -5.8350 2.2110 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 1 18 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 19 1 0 0 0 0 4 5 1 0 0 0 0 4 15 1 0 0 0 0 5 6 2 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 20 1 0 0 0 0 8 9 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 11 12 1 0 0 0 0 11 21 1 0 0 0 0 11 22 1 0 0 0 0 12 13 2 0 0 0 0 12 26 1 0 0 0 0 15 23 1 0 0 0 0 15 24 1 0 0 0 0 15 25 1 0 0 0 0 M CHG 1 26 -1 M END