MMs02485886 MOE2007 2D CORINA 3.40 0006 02.08.2006 69 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 1.2979 -0.7519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0038 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2958 -2.2519 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5937 -3.0038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5915 -4.5038 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5523 -3.9038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8894 -5.2557 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8502 -5.8557 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1896 -4.5076 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.1896 -5.7076 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1918 -3.0076 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.1918 -1.8076 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4919 -2.2595 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.5311 -1.6595 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7898 -3.0114 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4248 -4.4663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6957 -5.2630 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8462 -4.3005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2863 -2.9089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2116 -1.7283 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6967 -1.9392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2565 -3.3308 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.3313 -4.5114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8912 -5.9030 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 13.3763 -6.1140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4941 -0.7595 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -0.0114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8938 -2.2557 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2842 -0.8074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7336 -0.4213 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2251 0.2548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4875 -5.2595 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4853 -6.7595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7833 -7.5114 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1852 -7.5076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8873 -6.7557 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5871 -7.5038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5849 -9.0038 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2892 -6.7519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2914 -5.2519 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0066 -4.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3067 -5.2481 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0044 -3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6015 1.0384 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0384 0.6015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6015 -1.0384 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0058 -1.8768 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7752 -3.2139 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8682 -4.6902 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4368 -0.9946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2075 -7.3020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5644 -6.2827 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5450 -4.9259 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3927 -1.0515 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8343 0.5871 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1957 1.0287 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0748 1.1021 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3778 1.1046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3753 -0.5924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5867 -6.4675 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1451 -8.1061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7837 -8.5477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8907 -5.7135 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2508 -6.1504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6877 -7.7902 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1956 -3.0017 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0026 -1.8000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2044 -2.9982 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 45 1 0 0 0 0 1 46 1 0 0 0 0 1 47 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 5 6 1 0 0 0 0 5 48 1 0 0 0 0 5 49 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 41 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 37 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 33 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 29 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 27 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 17 18 2 0 0 0 0 17 50 1 0 0 0 0 18 19 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 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 26 54 1 0 0 0 0 27 28 1 0 0 0 0 28 55 1 0 0 0 0 28 56 1 0 0 0 0 28 57 1 0 0 0 0 29 30 1 0 0 0 0 30 31 2 0 0 0 0 30 32 1 0 0 0 0 32 58 1 0 0 0 0 32 59 1 0 0 0 0 32 60 1 0 0 0 0 33 34 1 0 0 0 0 34 35 2 0 0 0 0 34 36 1 0 0 0 0 36 61 1 0 0 0 0 36 62 1 0 0 0 0 36 63 1 0 0 0 0 37 38 1 0 0 0 0 38 39 2 0 0 0 0 38 40 1 0 0 0 0 40 64 1 0 0 0 0 40 65 1 0 0 0 0 40 66 1 0 0 0 0 41 42 1 0 0 0 0 42 43 2 0 0 0 0 42 44 1 0 0 0 0 44 67 1 0 0 0 0 44 68 1 0 0 0 0 44 69 1 0 0 0 0 M END