IBS-ZINC04741869 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 30 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3850 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 1.1830 -0.6910 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3940 0.0080 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3760 1.4210 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1600 2.1020 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6630 2.1320 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7120 3.3490 -0.0150 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7900 1.3840 -0.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6570 1.8180 -0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7140 0.0170 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5780 -0.6350 -0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9700 -0.7580 -0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2010 -0.0990 -0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3710 -0.8280 -0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3310 -2.2140 -0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1190 -2.8770 -0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9340 -2.1580 -0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7420 -2.8090 -0.0420 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0380 0.0640 -0.0870 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 1.9070 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9300 -0.5490 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1810 -1.7710 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1400 3.1820 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2370 0.9810 -0.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2510 -2.7780 -0.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0950 -3.9560 -0.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3870 -2.9970 -0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 21 1 0 0 0 0 2 3 2 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 3 23 1 0 0 0 0 4 5 2 0 0 0 0 4 12 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 24 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 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 14 25 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 16 17 2 0 0 0 0 16 26 1 0 0 0 0 17 18 1 0 0 0 0 17 27 1 0 0 0 0 18 19 1 0 0 0 0 19 28 1 0 0 0 0 M END