MMs02331578 MOE2007 2D CORINA 3.40 0006 02.08.2006 50 52 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 -1.2965 0.7543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5981 0.0086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6030 -1.4914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3065 -2.2457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2916 -2.2543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2866 -3.7543 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5931 -1.5086 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8896 -2.2629 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.8896 -1.0629 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8847 -3.7629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1812 -4.5172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4827 -3.7715 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1912 -1.5172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4877 -2.2715 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8946 0.7629 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1961 0.0172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4927 0.7715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4877 2.2715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7842 3.0258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0858 2.2801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0907 0.7801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7942 0.0258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3922 0.0345 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3972 -1.4655 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.6888 0.7888 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.7300 0.1922 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6838 2.2887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3823 3.0344 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.9804 3.0431 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0412 0.5966 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2926 1.9543 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6442 -2.0879 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3105 -3.4457 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5971 -0.3086 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7036 -3.5506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4705 -4.8892 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8906 1.9629 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4278 -0.9046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9705 -0.8995 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4465 2.8681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7803 4.2258 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7982 -1.1742 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9764 4.2430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.0216 2.4465 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1762 -6.0172 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0172 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2373 0.5793 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2135 -6.6206 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 32 1 0 0 0 0 2 3 2 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 17 1 0 0 0 0 4 5 2 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 15 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 2 0 0 0 0 13 47 1 0 0 0 0 15 16 2 0 0 0 0 15 48 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 23 2 0 0 0 0 22 30 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 44 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 45 1 0 0 0 0 31 46 1 0 0 0 0 47 50 1 0 0 0 0 48 49 1 0 0 0 0 M END