MMs01958645 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 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 0.6489 -1.3524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0638 -2.6723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9713 -3.7579 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3237 -3.1090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1244 -1.6223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3123 -0.7064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6995 -1.2772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8874 -0.3613 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2745 -0.9321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4738 -2.4188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8609 -2.9896 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2859 -3.3347 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8987 -2.7639 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7108 -3.6798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4624 -0.0162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8496 -0.5870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0488 -2.0737 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0375 0.3290 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.4246 -0.2418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6125 0.6741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9997 0.1033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1989 -1.3834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0110 -2.2993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6239 -1.7285 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6881 1.1254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0819 0.5191 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5191 1.0819 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0819 -0.5191 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2531 -2.8317 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1529 0.4830 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8702 -4.8692 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5758 0.7925 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1048 0.9974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8781 1.5183 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4531 1.8634 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9500 0.8360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3087 -1.8401 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1704 -3.4887 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8775 1.2848 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5287 2.3148 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4988 0.9660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 15 2 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 14 2 0 0 0 0 9 10 2 0 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 10 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 14 15 1 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 16 34 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 36 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 23 24 2 0 0 0 0 23 38 1 0 0 0 0 24 25 1 0 0 0 0 24 39 1 0 0 0 0 26 40 1 0 0 0 0 26 41 1 0 0 0 0 26 42 1 0 0 0 0 M END