CHEMDIV-ZINC05049112 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 44 0 0 0 0 0 0 0 0999 V2000 1.5900 1.4430 -0.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7830 -0.0500 -0.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1680 -0.7600 0.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3440 -2.1310 0.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1450 -2.8080 -0.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7670 -2.1160 -1.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5700 -0.7240 -1.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1190 -0.0510 -2.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6500 -0.8010 -3.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2770 -0.0410 -4.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4220 1.3090 -4.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0690 1.6520 -3.1070 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0880 2.3160 -5.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2050 1.9730 -6.8450 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1060 3.6250 -5.3910 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4320 4.0370 -4.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1870 4.5890 -6.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3360 5.9200 -5.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6240 6.8700 -6.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7660 6.4960 -8.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6190 5.1700 -8.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3250 4.2170 -7.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1620 7.8000 -9.5920 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.5910 -2.3160 -3.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6030 -2.7520 -2.7570 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5310 1.9430 -0.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8300 1.7470 -0.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2710 1.7190 0.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3330 -0.2440 1.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6390 -2.6780 1.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2860 -3.8780 -0.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1060 -0.4770 -5.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5150 4.0750 -3.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 5.0230 -3.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 3.3190 -3.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2260 6.2130 -4.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7400 7.9060 -6.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7310 4.8810 -9.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2060 3.1830 -7.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3940 -2.6160 -3.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7740 -2.7650 -4.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 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 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 24 1 0 0 0 0 10 11 2 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 13 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 17 1 0 0 0 0 16 33 1 0 0 0 0 16 34 1 0 0 0 0 16 35 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 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 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 38 1 0 0 0 0 22 39 1 0 0 0 0 24 25 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 M END