CHEMBRIDGE-ZINC03105879 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 41 0 0 1 0 0 0 0 0999 V2000 -0.6070 2.0830 1.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2290 0.7020 1.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2910 -0.2340 1.0860 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3810 -1.8190 1.4650 P 0 0 3 0 0 0 0 0 0 0 0 0 -2.1840 -2.5580 1.2650 S 0 0 0 0 0 0 0 0 0 0 0 0 0.1560 -1.7650 3.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2190 -2.8110 0.4930 S 0 0 0 0 0 0 0 0 0 0 0 0 0.9970 -4.5620 0.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2630 -5.3350 0.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5470 -5.6990 -0.5460 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0420 -5.5690 1.7020 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2700 -6.3810 1.7290 C 0 0 3 0 0 0 0 0 0 0 0 0 4.7920 -6.2630 0.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9840 -7.8590 2.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2410 -8.5980 0.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9070 -8.9980 -0.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2170 -9.6650 -1.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8580 -9.9420 -1.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1880 -9.5540 0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8760 -8.8840 1.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1880 -5.9350 2.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5950 -5.2300 3.7780 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3240 2.3390 0.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3030 2.8390 1.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3080 2.1160 2.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5030 0.4570 2.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1290 0.6750 0.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5670 -1.2330 3.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2620 -2.7800 3.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1220 -1.2590 3.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7330 -4.6650 1.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1790 -4.9810 0.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8350 -5.1520 2.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9190 -8.4060 2.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4160 -7.9360 2.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9660 -8.7840 -0.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7390 -9.9640 -2.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3220 -10.4580 -1.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1280 -9.7640 0.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3390 -8.5760 1.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3880 -6.3250 2.8460 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 4 7 1 0 0 0 0 6 28 1 0 0 0 0 6 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 8 32 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 33 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 21 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 2 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 M CHG 1 41 -1 M END