MMs02424593 MOE2007 2D CORINA 3.40 0006 02.08.2006 78 81 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 1.5000 0.0050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2457 1.3065 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2543 -1.2916 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7543 -1.2866 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1543 -0.2474 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5086 -2.5831 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.1086 -3.6224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0086 -2.5782 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.2086 -2.5782 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7543 -1.2766 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.3543 -0.2374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 0.0199 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0149 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.1000 1.0542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7457 1.3115 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4914 2.6130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7371 3.9095 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9914 2.6180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2543 -1.2717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0000 0.0298 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4999 0.0348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9999 0.0398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7456 1.3413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2456 1.3463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9999 0.0497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2542 -1.2518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7542 -1.2567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4950 1.5348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7915 2.2891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7865 3.7891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4850 4.5348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1885 3.7805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1934 2.2805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5049 -1.4652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8064 -2.2109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8114 -3.7108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5149 -4.4652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2133 -3.7195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2084 -2.2195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7629 -3.8747 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0172 -5.1762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7715 -6.4728 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5172 -5.1812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7629 -3.8847 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2629 -3.8896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5172 -5.1911 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5086 -2.5931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9560 -1.8122 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9953 1.4180 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1913 2.6219 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9874 3.8180 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0498 -2.4541 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3832 -1.6784 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4439 1.8599 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8422 2.3875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1999 0.0537 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8577 -2.2890 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4560 -1.7774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3121 1.9908 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8238 4.3926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4810 5.7348 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1473 4.3770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1562 1.6771 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3251 -1.9091 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8526 -4.3074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5188 -5.6651 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1761 -4.3229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6878 -1.9212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5132 -3.9812 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3172 -5.1852 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5212 -6.3812 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5458 -1.9896 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9052 -1.5559 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4714 -3.1965 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 49 1 0 0 0 0 1 50 1 0 0 0 0 1 51 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 52 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 14 1 0 0 0 0 7 8 1 0 0 0 0 7 9 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