MMs01209953 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 46 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 1.5000 -0.0057 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2549 1.2905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2451 -1.3075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7451 -1.3132 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4902 -2.6037 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8902 -3.6430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0098 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7549 -1.2962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2549 -1.2905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0098 -2.5867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2647 -3.8886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7647 -3.8943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2353 -3.9056 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7264 -4.0680 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.8855 -4.3786 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0328 -5.5364 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.7309 -6.2815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6200 -5.2736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1516 -5.5799 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7343 -2.9571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2762 -1.5288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2841 -0.4179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7501 -0.7353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2083 -2.1636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2004 -3.2745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7580 0.3756 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 0.0045 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0045 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2918 0.6866 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8588 2.3275 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2179 1.8944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4529 -0.7777 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8510 -0.2490 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2098 -2.5822 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8686 -4.9255 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1687 -4.9357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4326 -7.2550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8361 -7.0811 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1034 -1.2749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9176 0.7248 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3811 -2.4175 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5669 -4.4172 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 1 0 0 0 0 2 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 14 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 34 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 11 12 2 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 21 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 19 20 2 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 26 44 1 0 0 0 0 M END