IFLAB-ZINC02451625 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3790 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 1.2050 -0.6800 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4030 0.0330 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4270 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 2.0930 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6970 -0.6870 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8860 -0.0900 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9370 -1.1770 -0.0600 C 0 0 3 0 0 0 0 0 0 0 0 0 6.5470 -1.1030 -0.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1740 -2.4360 -0.0590 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8220 -2.0700 -0.0380 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6750 -3.6870 -0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8760 -3.8600 -0.0820 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7440 -4.8720 -0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5620 -6.1640 -0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6160 -7.3670 -0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4230 -8.6400 -0.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6300 -8.5900 -0.1040 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8050 -1.0850 1.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0610 -0.5140 1.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8570 -0.4290 2.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3960 -0.9160 3.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1390 -1.4880 3.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3420 -1.5670 2.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4850 -0.8010 4.9660 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9040 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -1.7600 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3020 1.9850 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 3.1720 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0670 0.9750 -0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0790 -2.6930 -0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1240 -4.8440 0.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1070 -4.8350 -0.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1820 -6.1920 -0.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1990 -6.2010 0.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9960 -7.3390 0.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9800 -7.3300 -0.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4210 -0.1340 0.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8380 0.0170 2.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7800 -1.8690 4.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3590 -2.0100 2.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8000 -9.8290 -0.0930 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3590 -10.6180 -0.1020 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 20 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 33 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 44 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 43 1 0 0 0 0 44 45 1 0 0 0 0 M END