MMs01390557 MOE2007 2D CORINA 3.40 0006 02.08.2006 59 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 1.3005 -0.7475 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3034 -2.2475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0051 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 1.8455 1.3026 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3506 -1.2925 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8956 0.7576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8927 2.2576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1903 3.0101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4908 2.2627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4937 0.7627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 0.0152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7971 -1.4848 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0918 0.7677 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3923 0.0203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6899 0.7728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9373 2.0704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6848 3.3709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1848 3.3738 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9373 2.0762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1899 0.7757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3952 -1.4797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3981 -2.9797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6986 -3.7272 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9962 -2.9746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9933 -1.4747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5980 1.0404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0404 0.5980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5980 -1.0404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1034 -2.2498 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3058 -3.4475 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5034 -2.2451 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8523 2.8556 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1879 4.2101 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5288 2.8647 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1985 -1.1899 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0894 1.9677 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6227 -0.9005 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1654 -0.8975 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0196 1.2972 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0166 2.8399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5564 3.7791 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8909 4.5531 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9741 4.5552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3116 3.7864 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8551 2.8494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8581 1.3067 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0868 0.1846 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3183 0.3675 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2139 -1.6904 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9826 -0.3529 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2160 -2.7736 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9899 -4.1081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4088 -4.1015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1776 -2.7640 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1755 -1.6807 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1974 -0.9104 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6928 -0.7272 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 6 2 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 10 11 2 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 37 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 17 59 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 22 49 1 0 0 0 0 22 50 1 0 0 0 0 23 24 1 0 0 0 0 23 51 1 0 0 0 0 23 52 1 0 0 0 0 23 59 1 0 0 0 0 24 25 1 0 0 0 0 24 53 1 0 0 0 0 24 54 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 55 1 0 0 0 0 26 56 1 0 0 0 0 27 57 1 0 0 0 0 27 58 1 0 0 0 0 27 59 1 0 0 0 0 M END