MMs01086935 MOE2007 2D CORINA 3.40 0006 02.08.2006 77 79 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 1.3002 -0.7481 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2609 -1.3481 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0039 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5588 0.6039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5958 1.5039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8938 2.2558 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2957 2.2519 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2935 3.7519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8982 -0.7442 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1939 1.5077 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4963 -0.7404 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.5355 -1.3404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4985 -2.2404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2006 -2.9923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9005 -2.2442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6025 -2.9961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6048 -4.4961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9049 -5.2442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2028 -4.4923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3068 -5.2481 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 0.0116 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7920 1.5116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4918 2.2596 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0899 2.2635 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.0507 2.8635 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0877 3.7635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3856 4.5154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3834 6.0154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6813 6.7673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9815 6.0193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9837 4.5193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6858 3.7674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3901 1.5154 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3923 0.0154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0944 -0.7365 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6924 -0.7326 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6947 -2.2326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9948 -2.9807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2927 -2.2288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5929 -2.9769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5951 -4.4769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2972 -5.2288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9970 -4.4807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3024 -2.2481 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5985 1.0401 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0401 0.5985 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5985 -1.0401 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4935 3.7537 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2917 4.9519 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0935 3.7501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8991 -1.3442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6800 -2.0302 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9106 -3.3674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8996 -1.6442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0825 -2.6969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9067 -6.4442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2429 -5.0907 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3086 -6.4481 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3143 -0.2877 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9062 3.5534 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6756 4.8905 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3433 6.6139 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6795 7.9673 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0198 6.6208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0238 3.9208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6875 2.5674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4284 2.1170 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5126 -2.0260 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2859 -3.3609 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2910 -1.0288 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6312 -2.3753 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6352 -5.0753 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2990 -6.4288 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9587 -5.0823 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2640 -2.8496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 47 1 0 0 0 0 1 48 1 0 0 0 0 1 49 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 46 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 10 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 9 50 1 0 0 0 0 9 51 1 0 0 0 0 9 52 1 0 0 0 0 10 11 1 0 0 0 0 10 53 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 23 1 0 0 0 0 15 16 1 0 0 0 0 15 54 1 0 0 0 0 15 55 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 56 1 0 0 0 0 18 19 1 0 0 0 0 18 57 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 58 1 0 0 0 0 21 59 1 0 0 0 0 22 60 1 0 0 0 0 23 24 1 0 0 0 0 23 61 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 35 1 0 0 0 0 28 29 1 0 0 0 0 28 62 1 0 0 0 0 28 63 1 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 30 64 1 0 0 0 0 31 32 1 0 0 0 0 31 65 1 0 0 0 0 32 33 2 0 0 0 0 32 66 1 0 0 0 0 33 34 1 0 0 0 0 33 67 1 0 0 0 0 34 68 1 0 0 0 0 35 36 1 0 0 0 0 35 69 1 0 0 0 0 36 37 2 0 0 0 0 36 38 1 0 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 39 70 1 0 0 0 0 39 71 1 0 0 0 0 40 41 1 0 0 0 0 40 45 2 0 0 0 0 41 42 2 0 0 0 0 41 72 1 0 0 0 0 42 43 1 0 0 0 0 42 73 1 0 0 0 0 43 44 2 0 0 0 0 43 74 1 0 0 0 0 44 45 1 0 0 0 0 44 75 1 0 0 0 0 45 76 1 0 0 0 0 46 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