MMs01659962 MOE2007 2D CORINA 3.40 0006 02.08.2006 49 51 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 0.7457 1.3015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2457 1.3065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 0.0100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2543 -1.2916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7543 -1.2965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2543 -1.2816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7543 -1.2766 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.1543 -2.3158 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6400 -2.4872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1812 -3.9153 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0650 -2.0189 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0600 -0.5189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2706 0.3668 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6319 -0.0602 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.2815 -2.8966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6498 -2.2819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8016 -0.7896 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.8662 -3.1596 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.2345 -2.5449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3863 -1.0526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7546 -0.4379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9711 -1.3156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8192 -2.8079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4509 -3.4225 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.3393 -0.7009 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 17.7247 0.6673 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.9540 -2.0692 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.7076 -0.0863 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1422 2.3388 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8422 2.3477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8578 -2.3288 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1578 -2.3378 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2877 1.1960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6262 0.4291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1280 -1.6958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4666 -2.4627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2573 1.0799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4210 -3.7330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9558 -3.8892 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7447 -4.3534 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4132 -0.3505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8761 0.7559 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.7924 -3.5100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3295 -4.6164 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.6808 -0.7884 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.8291 1.1076 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 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 16 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 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 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 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 46 1 0 0 0 0 26 47 1 0 0 0 0 27 28 2 0 0 0 0 27 29 2 0 0 0 0 27 30 1 0 0 0 0 30 48 1 0 0 0 0 30 49 1 0 0 0 0 M END