CHEMDIV-ZINC03013685 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 1 0 0 0 0 0999 V2000 -0.0150 1.3750 -0.1000 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 -0.6760 0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 0.0340 0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4180 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0850 -0.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6700 2.1920 -0.0210 C 0 0 3 0 0 0 0 0 0 0 0 0 4.4640 1.6080 0.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6470 4.6650 -0.1680 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6780 4.9300 -0.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6500 4.3590 -1.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1350 2.6410 -1.7390 S 0 0 0 0 0 0 0 0 0 0 0 0 4.1660 5.8140 0.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7140 5.6000 1.7130 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5820 -0.6240 0.1830 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5270 -2.0480 0.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9260 -2.6000 0.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5220 -2.7650 1.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8050 -3.2720 1.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4930 -3.6140 0.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8960 -3.4490 -0.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6100 -2.9470 -0.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2480 -4.3060 0.6690 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.9570 1.8980 -0.1780 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 -1.7530 0.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1550 3.1620 -0.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5040 5.0340 -2.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6810 4.3880 -0.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9660 -2.3270 1.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0330 -2.4580 -0.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9860 -2.4980 2.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2710 -3.4000 2.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4320 -3.7150 -1.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1430 -2.8220 -1.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5010 3.4780 0.6800 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6300 3.5020 1.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0180 7.0740 0.2210 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3660 7.7780 0.7860 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 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 4 5 2 0 0 0 0 4 15 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 7 36 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 13 1 0 0 0 0 9 36 1 0 0 0 0 11 12 1 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 13 14 2 0 0 0 0 13 38 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 30 1 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 32 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 34 1 0 0 0 0 22 35 1 0 0 0 0 36 37 1 0 0 0 0 38 39 1 0 0 0 0 M END