MMs03746635 MOE2007 2D CORINA 3.40 0006 02.08.2006 58 61 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 1.2965 -0.7544 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6032 1.4911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9048 2.2366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2013 1.4822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8945 -0.7633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8894 -2.2633 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5878 -3.0089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5826 -4.5089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8791 -5.2633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8740 -6.7633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5724 -7.5089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2759 -6.7544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2810 -5.2544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0154 -4.5000 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 6.4926 -0.7722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -0.0267 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0906 -0.7811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0855 -2.2811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3820 -3.0356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6836 -2.2900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6887 -0.7900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 -0.0356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9903 -0.0445 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 12.9800 -3.0445 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.2816 -2.2989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5781 -3.0534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5729 -4.5534 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2713 -5.2989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9749 -4.5445 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6036 1.0372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0372 0.6036 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6036 -1.0372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5660 2.0946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9089 3.4366 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2425 2.0786 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1812 -1.8799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4053 -3.2132 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9204 -4.6669 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9111 -7.3669 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5683 -8.7088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2346 -7.3508 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7181 -1.6889 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2608 -1.6941 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7983 1.1733 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0442 -2.8776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3779 -4.2356 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3964 1.1644 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5134 -1.3771 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0561 -1.3823 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9924 -1.9272 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7591 -3.2658 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0395 -6.2208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4969 -6.2155 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7938 -4.3321 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5606 -5.6707 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 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 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 6 7 2 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 18 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 14 15 2 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 47 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 48 1 0 0 0 0 22 23 1 0 0 0 0 22 49 1 0 0 0 0 23 24 2 0 0 0 0 23 27 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 50 1 0 0 0 0 27 28 1 0 0 0 0 27 32 1 0 0 0 0 28 29 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 29 30 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 31 55 1 0 0 0 0 31 56 1 0 0 0 0 32 57 1 0 0 0 0 32 58 1 0 0 0 0 M END