MMs01727737 MOE2007 2D CORINA 3.40 0006 02.08.2006 69 71 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 -1.2966 -0.7542 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2966 0.4458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2918 -2.2542 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2918 -3.4542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0096 -3.0000 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0489 -3.6000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3063 -2.2458 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3455 -1.6458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3014 -0.7458 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3014 0.4542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6077 -2.9916 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9043 -2.2375 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9043 -3.4375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2058 -2.9833 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.2450 -3.5833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5024 -2.2291 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.5416 -1.6291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4976 -0.7291 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.4976 0.4709 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0167 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.1569 0.6167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8995 -0.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1913 1.5167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4879 2.2709 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 0.0251 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2106 -4.4833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0145 -4.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5884 -3.0083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8899 -2.2625 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.8899 -3.4625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1865 -3.0167 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.2257 -3.6167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4879 -2.2709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4927 -0.7709 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.5320 -1.3709 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1961 -0.0167 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.2354 0.5833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8947 -0.7625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2009 1.4833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7942 -0.0251 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7743 0.9168 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7684 0.9217 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1186 -0.2900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0102 1.3045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7773 2.6430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4841 3.4709 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8353 -0.5716 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8077 -4.1749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2518 -5.0799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0228 -5.1033 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8947 -3.3998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6704 -2.0663 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0185 1.2787 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7942 2.6122 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5063 3.4291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8315 -0.6284 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2189 -5.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6019 1.1916 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0084 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5942 1.2083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8038 -2.9749 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.8411 -2.3716 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5024 2.2291 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.5397 1.6258 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1817 -4.5167 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1405 -5.1133 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5981 -0.0084 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1167 -0.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 10 1 0 0 0 0 1 42 1 0 0 0 0 1 43 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 68 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 29 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 28 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 12 1 0 0 0 0 10 11 1 0 0 0 0 10 60 1 0 0 0 0 12 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 17 1 0 0 0 0 15 27 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 62 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 26 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 24 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 25 47 1 0 0 0 0 26 48 1 0 0 0 0 27 50 1 0 0 0 0 28 51 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 30 39 1 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 32 66 1 0 0 0 0 34 35 1 0 0 0 0 34 52 1 0 0 0 0 34 53 1 0 0 0 0 35 36 1 0 0 0 0 35 37 1 0 0 0 0 35 41 1 0 0 0 0 37 38 1 0 0 0 0 37 39 1 0 0 0 0 37 40 1 0 0 0 0 40 54 1 0 0 0 0 40 55 1 0 0 0 0 40 64 1 0 0 0 0 41 57 1 0 0 0 0 44 60 1 0 0 0 0 49 62 1 0 0 0 0 56 64 1 0 0 0 0 58 66 1 0 0 0 0 59 68 1 0 0 0 0 60 61 1 0 0 0 0 62 63 1 0 0 0 0 64 65 1 0 0 0 0 66 67 1 0 0 0 0 68 69 1 0 0 0 0 M END