CHEMBRIDGE-ZINC02307211 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 0 0 0 0 0 0999 V2000 0.4530 2.6210 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3450 1.3060 -0.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2490 0.4840 0.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2400 1.4440 1.3060 S 0 0 0 0 0 0 0 0 0 0 0 0 1.4080 2.8720 0.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3660 -0.9100 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5990 -1.4870 -0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8600 -0.8400 -0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9610 0.3740 -0.1100 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9190 -1.6280 -0.1890 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7420 -2.9570 -0.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9590 -4.1580 -0.2780 S 0 0 0 0 0 0 0 0 0 0 0 0 2.9900 -3.2180 -0.0990 S 0 0 0 0 0 0 0 0 0 0 0 0 6.2670 -1.0580 -0.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8140 -0.8780 1.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2220 -0.2820 1.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7610 -0.1050 2.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0860 -0.4240 3.4460 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9930 0.4080 2.6770 N 0 0 0 0 0 0 0 0 0 0 0 0 10.5360 0.4670 3.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2340 -0.5260 4.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7600 -0.4770 6.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6080 0.5730 6.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9170 1.5760 5.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3820 1.5130 4.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7380 2.5990 5.9250 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1750 0.6270 7.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9120 1.5410 8.1850 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1840 3.3960 -0.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3800 0.9550 -1.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6240 3.8480 1.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4790 -1.5180 -0.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9190 -1.7300 -0.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2280 -0.0900 -0.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1620 -0.2060 1.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8530 -1.8460 1.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8740 -0.9540 0.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1830 0.6850 0.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5020 0.7350 1.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5790 -1.3390 4.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5200 -1.2510 6.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6180 2.2790 3.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6740 2.4270 5.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8770 -0.3370 8.7630 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2730 -0.2590 9.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 5 31 1 0 0 0 0 6 7 2 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 13 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 27 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 42 1 0 0 0 0 26 43 1 0 0 0 0 27 28 2 0 0 0 0 27 44 1 0 0 0 0 44 45 1 0 0 0 0 M END