MMs03954317 MOE2007 2D CORINA 3.40 0006 02.08.2006 52 53 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 -1.2942 -0.7582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2847 -2.2582 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5980 -0.0165 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6076 1.4834 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.6468 0.8834 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9113 2.2252 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.9506 2.8252 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9209 3.7251 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.9209 4.9251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6266 4.4834 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5874 5.0834 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3229 3.7417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3133 2.2417 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2741 2.8417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0095 1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2847 2.2582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5885 1.5165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8827 2.2747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1865 1.5330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 0.0330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9018 -0.7252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6362 5.9834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3419 6.7416 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2247 4.4669 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5189 3.7086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5094 2.2087 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8227 4.4503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2056 1.4669 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1960 -0.0330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8923 -0.7748 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4903 -0.7913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6066 -1.0354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0354 0.6066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6066 1.0354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1157 -0.3198 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5075 3.1725 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0502 3.1824 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8751 3.4747 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2219 2.1396 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2391 -0.5603 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9094 -1.9252 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5626 -0.5901 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2293 5.4934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8657 5.0437 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4161 3.4073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0969 0.2441 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5257 -1.3979 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8837 -1.8267 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9400 6.7251 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9476 7.9251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 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 37 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 1 0 0 0 0 7 30 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 26 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 24 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 44 1 0 0 0 0 24 25 2 0 0 0 0 24 51 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 45 1 0 0 0 0 29 46 1 0 0 0 0 29 47 1 0 0 0 0 30 31 1 0 0 0 0 31 32 2 0 0 0 0 31 33 1 0 0 0 0 33 48 1 0 0 0 0 33 49 1 0 0 0 0 33 50 1 0 0 0 0 51 52 1 0 0 0 0 M END