CHEMBRIDGE-ZINC02824138 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 45 0 0 1 0 0 0 0 0999 V2000 -0.2210 1.4210 -0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0940 -0.0970 -0.0450 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1020 -0.5230 -0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7240 -0.5490 1.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5770 -2.4420 -0.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7640 -1.9050 -1.3820 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3730 -2.0370 -2.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5420 -0.4930 -1.2660 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5430 -2.6610 -1.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6750 -2.5540 2.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5120 -4.0580 2.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1880 -4.5650 3.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9880 -5.9760 3.8120 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5290 -6.6740 4.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2580 -6.1190 5.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7780 -6.9400 6.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5790 -8.3230 6.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8540 -8.8980 5.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3400 -8.0620 4.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5870 -8.6680 3.7830 N 0 3 0 0 0 0 0 0 0 0 0 0 0.3530 -8.6010 3.8530 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2360 -9.2130 2.8810 O 0 5 0 0 0 0 0 0 0 0 0 0 0.7620 1.8970 -0.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8020 1.7410 -0.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7150 1.7930 0.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7270 -0.1050 1.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2050 -0.3120 2.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6570 -3.5320 -0.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5780 -1.9970 -0.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2070 -2.6280 -0.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0950 -2.2160 -2.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3470 -3.7120 -1.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2490 -2.0410 3.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7230 -2.2570 2.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4480 -4.3290 2.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9380 -4.5950 1.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2590 -4.3340 3.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7290 -4.0930 4.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4450 -5.0520 5.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3450 -6.4960 7.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9910 -8.9470 7.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6980 -9.9740 5.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9170 -2.0610 1.1250 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.0190 -2.4880 1.1530 H 0 0 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 4 1 0 0 0 0 2 8 1 0 0 0 0 4 26 1 0 0 0 0 4 27 1 0 0 0 0 4 43 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 5 29 1 0 0 0 0 5 43 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 10 43 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 2 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 43 44 1 0 0 0 0 M CHG 1 20 1 M CHG 1 22 -1 M CHG 1 43 1 M END