MMs02722527 MOE2007 2D CORINA 3.40 0006 02.08.2006 47 49 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 -1.2982 0.7514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5981 0.0027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5997 -1.4973 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3014 -2.2486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0016 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2967 -2.2514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5965 -1.5027 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8947 -2.2541 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8932 -3.7541 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1946 -1.5055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4960 0.7432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -0.0082 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7926 -1.5082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4928 -2.2568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0940 0.7404 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.3454 2.0403 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8427 -0.5594 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3939 1.4891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3955 2.9891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6953 3.7377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9935 2.9864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9919 1.4864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6921 0.7377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6905 -0.7623 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 11.6969 5.2377 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.8963 0.7541 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0399 0.5989 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2970 1.9514 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6395 -2.0962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3027 -3.4486 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5244 -3.1698 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0671 -3.1714 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5978 -0.3027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1946 -2.7055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0142 -0.2126 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7869 1.1226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7256 1.6632 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2683 1.6616 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9746 -1.3011 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2019 -2.6362 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7205 -3.1753 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2632 -3.1769 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3569 3.5902 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0334 3.5853 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0305 0.8853 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 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 35 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 16 1 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 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 18 2 0 0 0 0 17 19 2 0 0 0 0 17 20 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 45 1 0 0 0 0 22 23 1 0 0 0 0 22 27 1 0 0 0 0 23 24 2 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 M END