ASINEX-ZINC04587918 MOE2007 3D CORINA 3.40 0006 02.08.2006 26 27 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.7000 1.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0900 1.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.7880 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -2.0710 -1.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6900 -1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0430 0.2740 -2.8280 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -4.1540 0.2210 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0770 -4.4080 1.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0980 -5.5090 2.0590 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 -3.1140 2.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0760 -2.9150 3.5480 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1000 -4.0070 4.4240 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1100 -3.8020 5.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1390 -5.1380 6.8280 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0980 -2.5460 6.2450 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1670 2.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.5940 -2.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -4.8390 -0.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1090 -4.9110 4.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 -1.7900 5.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1050 -2.3990 7.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 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 21 1 0 0 0 0 4 5 1 0 0 0 0 4 12 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 22 1 0 0 0 0 7 8 1 0 0 0 0 9 10 1 0 0 0 0 9 23 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 24 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 25 1 0 0 0 0 17 26 1 0 0 0 0 M END