MMs00567291 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 43 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 -1.2945 -0.7578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5980 -0.0157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6071 1.4843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3126 2.2421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0090 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2855 2.2578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5890 1.5156 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8835 2.2734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8744 3.7734 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1870 1.5313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4815 2.2891 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.7850 1.5469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0795 2.3048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3831 1.5626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4917 2.5730 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.6670 2.3306 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8734 3.9396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3826 3.7738 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3921 0.0626 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0976 -0.6952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 0.0470 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9106 2.2265 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2051 1.4687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1961 -0.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4906 -0.7891 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8925 -0.7735 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0428 -0.5937 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2873 -1.9578 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3198 3.4421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5086 3.1724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0512 3.1817 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5962 0.3156 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4212 0.6074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9639 0.6167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4671 4.9824 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1049 -1.8952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6223 2.5938 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3856 1.2532 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8853 -1.9734 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 23 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 22 2 0 0 0 0 14 15 2 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 18 36 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 38 1 0 0 0 0 24 39 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 40 1 0 0 0 0 M END