IFLAB-ZINC00086617 MOE2007 3D CORINA 3.40 0006 02.08.2006 21 21 0 0 1 0 0 0 0 0999 V2000 -0.0210 1.4410 0.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1130 0.0660 0.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0400 -0.6800 -0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3110 -0.0740 -0.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3980 1.3300 -0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 2.0670 0.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7120 2.0900 -0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2010 2.3650 -1.5120 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9870 1.5550 -2.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6300 2.7060 -1.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7510 3.0090 -1.5320 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1980 3.8960 -2.2650 Br 0 0 0 0 0 0 0 0 0 0 0 0 3.5090 -0.9730 -0.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5490 -0.4380 -0.9620 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9150 2.0280 0.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0760 -0.4300 0.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9520 -1.7600 -0.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2700 3.1450 0.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6140 3.0310 0.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4570 1.5260 0.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3780 -2.2060 -0.1860 O 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 15 1 0 0 0 0 2 3 2 0 0 0 0 2 16 1 0 0 0 0 3 4 1 0 0 0 0 3 17 1 0 0 0 0 4 5 2 0 0 0 0 4 13 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 18 1 0 0 0 0 7 8 1 0 0 0 0 7 19 1 0 0 0 0 7 20 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 12 1 0 0 0 0 10 11 3 0 0 0 0 13 14 1 0 0 0 0 13 21 2 0 0 0 0 M CHG 1 14 -1 M END