MMs01988413 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 45 0 0 0 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 1.3009 -0.7467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3047 -2.2467 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0066 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8990 -0.7401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9028 -2.2401 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0131 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4971 -0.7336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5009 -2.2336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8018 -2.9803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0989 -2.2270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0951 -0.7270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 0.0197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3999 -2.9737 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.1466 -1.6728 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6532 -4.2746 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7008 -3.7204 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9979 -2.9671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2989 -3.7138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5960 -2.9606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5922 -1.4606 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.2913 -0.7138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9941 -1.4671 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.2875 0.7861 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.5846 1.5394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8969 -3.7073 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.1941 -2.9540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5974 1.0407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0407 0.5974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5974 -1.0407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5950 1.2066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1931 1.2131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4632 -2.8362 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8048 -4.1803 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1328 -0.1244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7912 1.2197 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7038 -4.9204 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3019 -4.9138 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1872 0.5017 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6223 2.1421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9820 2.5771 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.7967 -3.9917 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2318 -2.3514 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.5914 -1.9163 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 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 31 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 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 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 2 0 0 0 0 14 16 2 0 0 0 0 14 17 1 0 0 0 0 17 18 1 0 0 0 0 17 37 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 38 1 0 0 0 0 20 21 1 0 0 0 0 20 26 1 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 25 39 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 26 27 1 0 0 0 0 27 42 1 0 0 0 0 27 43 1 0 0 0 0 27 44 1 0 0 0 0 M END