COMGENEX-ZINC04459464 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.7000 1.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.0800 1.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7780 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0780 -1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6820 -1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0210 -3.0130 -2.1920 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -4.2030 -1.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -4.0930 -0.3040 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -5.7240 -2.5330 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 -6.8940 -1.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0950 -8.3030 -1.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -9.0240 -1.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7670 -10.2740 -2.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5980 -10.2520 -2.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9860 -9.0480 -1.9500 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4860 -11.3470 -2.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0160 -12.3940 -3.2290 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8230 -11.1940 -2.7450 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7100 -12.2880 -3.1480 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.2530 -13.2420 -2.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9400 -12.2280 -4.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0510 -12.1500 -2.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8390 -12.3340 -0.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1590 -12.1990 -0.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9490 -13.3140 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1600 -13.1900 0.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5810 -11.9510 1.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7910 -10.8360 0.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5780 -10.9610 0.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1580 2.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.6150 2.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1360 -2.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9760 -6.7260 -0.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8040 -6.7490 -0.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2250 -8.6990 -1.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3920 -11.0940 -2.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1980 -10.3590 -2.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9840 -12.3260 -5.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6000 -13.0420 -4.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3970 -11.2740 -4.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4670 -11.1610 -2.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7410 -12.9110 -2.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4230 -13.3240 -0.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1490 -11.5740 -0.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6200 -14.2820 -0.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7780 -14.0600 0.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5280 -11.8540 1.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1200 -9.8680 1.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9580 -10.0900 0.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 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 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 5 6 2 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 37 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 15 16 2 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 24 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 28 51 1 0 0 0 0 29 30 2 0 0 0 0 29 52 1 0 0 0 0 30 31 1 0 0 0 0 30 53 1 0 0 0 0 31 54 1 0 0 0 0 M END