MMs00733297 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 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 1.2962 -0.7549 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2905 -2.2549 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0114 -3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0171 -4.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2791 -5.2549 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5810 -4.5098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5867 -3.0098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8885 -2.2648 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1847 -3.0197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1790 -4.5197 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4866 -2.2746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4923 -0.7746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -0.0296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0904 -0.7845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0847 -2.2845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7828 -3.0296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 -0.0394 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6884 -0.7944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9903 -0.0493 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2865 -0.8042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2808 -2.3042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9789 -3.0493 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6827 -2.2944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3808 -3.0394 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 12.9960 1.4507 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 11.6998 2.2056 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2979 2.1958 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 0.6039 1.0369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0369 0.6039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6039 -1.0369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0483 -2.3960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0586 -5.0960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2746 -6.4549 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6179 -5.1138 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8931 -1.0648 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4554 -0.1707 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7987 1.1704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6031 -2.5865 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7782 -4.2295 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3280 -0.2082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3177 -2.9081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9743 -4.2493 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 2 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 26 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 23 2 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 M CHG 1 26 1 M CHG 1 28 -1 M END