MMs01934745 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 44 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 1.3011 0.7464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8992 0.7391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0145 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4973 0.7319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5014 2.2319 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -0.0217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0953 0.7247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3923 -0.0289 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6934 0.7174 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.6934 -0.4826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6976 2.2174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9987 2.9638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0029 4.4638 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 14.3040 5.2102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9903 -0.0362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9862 -1.5362 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7900 -1.5217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0870 -2.2753 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4889 -2.2681 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1920 -1.5145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8908 -2.2608 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5971 1.0409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0409 -0.5971 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5971 -1.0409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5323 1.6678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0750 1.6635 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8242 -0.9243 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3668 -0.9286 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1304 1.6605 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6731 1.6562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0987 1.9247 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3889 -1.2289 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5152 2.0124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2903 3.3462 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4060 1.8351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1810 3.1689 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9011 4.1693 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3449 5.8073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7069 6.2511 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4856 -3.4681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2915 0.7102 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.3290 0.1073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 22 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 8 19 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 17 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 2 0 0 0 0 17 43 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 23 2 0 0 0 0 43 44 1 0 0 0 0 M END