IFLAB-ZINC00086617 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 22 0 0 1 0 0 0 0 0999 V2000 0.0720 1.4870 0.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0680 0.1270 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0450 -0.6570 -0.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3140 -0.0750 -0.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4480 1.2980 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3270 2.0700 0.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8130 1.9350 -0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2500 2.1760 -1.4760 C 0 0 3 0 0 0 0 0 0 0 0 0 4.2030 1.2390 -2.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6310 2.6870 -1.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6960 3.0810 -1.5060 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0540 3.4940 -2.3120 Br 0 0 0 0 0 0 0 0 0 0 0 0 3.5100 -0.9080 -0.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6010 -0.3860 -0.5830 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8020 2.0970 0.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0500 -0.3220 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9340 -1.7180 -0.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4290 3.1330 0.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7760 2.8860 0.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5280 1.2730 0.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3900 -2.2460 -0.5720 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2000 -2.7490 -0.7290 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 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 2 0 0 0 0 13 21 1 0 0 0 0 21 22 1 0 0 0 0 M END