CHEMDIV-ZINC02469067 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 39 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3780 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 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0280 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 -0.7070 -0.0370 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5540 -1.7260 -0.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2830 -0.7430 1.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3650 -0.2430 1.5820 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5930 -1.3320 2.3540 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1200 -1.3650 3.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5410 -1.9040 4.6660 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1860 -1.8440 5.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3670 -1.2260 5.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6310 -0.7080 4.0950 S 0 0 0 0 0 0 0 0 0 0 0 0 4.6460 -0.0180 -0.9300 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8030 -0.5110 -2.5040 S 0 0 0 0 0 0 0 0 0 0 0 0 5.7440 0.3660 -3.1070 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9660 -1.9220 -2.4680 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2610 -0.2090 -3.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9270 0.9200 -3.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6580 0.9270 -4.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9610 -0.1970 -4.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9290 -1.3540 -3.3990 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.7950 -0.5020 -4.9350 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -1.7590 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9630 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.1650 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7280 -1.7320 2.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7900 -2.2620 6.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0450 -1.0740 6.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1720 0.7270 -0.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5960 1.7650 -3.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2620 1.7780 -5.0150 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 1 0 0 0 0 7 9 1 0 0 0 0 7 17 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 11 32 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 18 19 2 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 21 22 2 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 36 1 0 0 0 0 23 24 2 0 0 0 0 23 37 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 M END