ASINEX-ZINC00045562 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 31 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3830 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 1.1980 -0.6870 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4020 0.0230 -0.0200 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 1.1630 2.0980 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7000 1.8360 -0.0230 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0190 2.7520 -0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4720 0.7090 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7070 -0.3540 -0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2340 0.6890 -0.0520 S 0 0 0 0 0 0 0 0 0 0 0 0 6.5280 -1.0970 -0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0110 -1.3620 -0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7020 -1.4900 1.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0630 -1.7330 1.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7330 -1.8500 -0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0410 -1.7220 -1.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6790 -1.4840 -1.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5940 -2.1820 -0.1250 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 1.9060 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 -0.5530 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2050 -1.7660 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1420 3.1780 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0880 -1.5430 0.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0710 -1.5350 -0.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1800 -1.3980 2.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6030 -1.8320 2.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5630 -1.8120 -2.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1380 -1.3880 -2.2120 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 20 1 0 0 0 0 2 3 2 0 0 0 0 2 21 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 23 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 24 1 0 0 0 0 12 25 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 26 1 0 0 0 0 15 16 1 0 0 0 0 15 27 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 28 1 0 0 0 0 18 29 1 0 0 0 0 M END