MMs00945749 MOE2007 2D CORINA 3.40 0006 02.08.2006 66 70 0 0 1 0 0 0 0 0999 V2000 0.0000 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3027 -0.7436 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0129 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5588 0.6129 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9008 -0.7307 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9008 0.4693 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9082 -2.2307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2109 -2.9742 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2184 -4.4742 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9231 -5.2306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6203 -4.4871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6129 -2.9871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3102 -2.2435 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0148 -3.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9305 -6.7306 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6352 -7.4870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5211 -5.2178 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5285 -6.7178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1887 1.5257 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4988 -0.7178 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 0.0386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0969 -0.7050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1043 -2.2050 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8090 -2.9614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5062 -2.2178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4070 -2.9485 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4145 -4.4485 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7172 -5.1921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0125 -4.4356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0051 -2.9357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7023 -2.1921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3004 -2.1792 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.5906 1.5128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8859 2.2693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8785 3.7692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5758 4.5128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2805 3.7564 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2879 2.2564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5948 1.0422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0422 0.5948 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5948 -1.0422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7291 -2.6717 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5841 -5.0922 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0300 -6.4508 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5989 -8.0922 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2403 -8.5233 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3285 -6.7237 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5345 -7.9178 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7285 -6.7118 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0182 0.9540 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5609 0.9616 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5017 0.4247 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2797 -0.9075 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5849 -3.8768 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0422 -3.8844 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3235 -2.0153 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1014 -3.3475 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3782 -5.0536 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7231 -6.3921 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0547 -5.0305 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6964 -0.9921 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4070 1.9718 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9148 4.3744 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5698 5.7128 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2516 1.6513 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 1 42 1 0 0 0 0 2 3 1 0 0 0 0 2 13 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 34 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 19 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 43 1 0 0 0 0 9 10 1 0 0 0 0 9 17 1 0 0 0 0 10 11 2 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 44 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 15 16 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 16 47 1 0 0 0 0 17 18 1 0 0 0 0 18 48 1 0 0 0 0 18 49 1 0 0 0 0 18 50 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 1 0 0 0 0 22 23 1 0 0 0 0 22 51 1 0 0 0 0 22 52 1 0 0 0 0 23 24 1 0 0 0 0 23 53 1 0 0 0 0 23 54 1 0 0 0 0 24 25 1 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 55 1 0 0 0 0 25 56 1 0 0 0 0 26 57 1 0 0 0 0 26 58 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 59 1 0 0 0 0 29 30 1 0 0 0 0 29 60 1 0 0 0 0 30 31 2 0 0 0 0 30 61 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 32 62 1 0 0 0 0 34 35 1 0 0 0 0 34 39 2 0 0 0 0 35 36 2 0 0 0 0 35 63 1 0 0 0 0 36 37 1 0 0 0 0 36 64 1 0 0 0 0 37 38 2 0 0 0 0 37 65 1 0 0 0 0 38 39 1 0 0 0 0 39 66 1 0 0 0 0 M END