MMs01145978 MOE2007 2D CORINA 3.40 0006 02.08.2006 53 55 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 0 0 0 0 0 0 0 0 0 0 1.3024 2.2481 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 3.9005 2.2442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8982 0.7442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5958 -1.5039 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5566 -0.9039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2957 -2.2519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1302 -1.7863 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0137 -2.9985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1338 -4.2133 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 1.2934 -3.7519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5914 -4.5039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8915 -3.7558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8938 -2.2558 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1939 -1.5077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0077 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4918 -2.2597 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7920 -1.5116 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -0.0116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0944 0.7364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0966 2.2364 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3968 2.9845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0899 -2.2635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3901 -1.5155 0.0000 O 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 -4.5155 0.0000 Cl 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 0.2641 2.8496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6043 4.1961 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9406 2.8426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4174 0.4434 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4993 -0.6445 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2137 -2.9967 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8187 -5.4220 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3613 -5.4243 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3003 -4.8840 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0736 -3.5492 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7191 -3.1778 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2618 -3.1801 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6121 -0.2182 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3855 1.1166 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5031 -0.3918 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2765 0.9431 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9952 1.9444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4369 3.5830 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7983 4.0246 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 -4.8906 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 5 6 2 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 17 1 0 0 0 0 10 11 1 0 0 0 0 10 14 2 0 0 0 0 11 12 2 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 20 44 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 45 1 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 M END