MMs01968002 MOE2007 2D CORINA 3.40 0006 02.08.2006 57 57 0 0 1 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 1.2946 0.7576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2554 1.3576 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2859 2.2576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0152 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.6373 -0.5848 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8927 0.7728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8839 2.2727 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0304 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4907 0.7879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 0.0456 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.7941 1.2456 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8029 -1.4544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1063 -2.1968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4009 -1.4392 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0887 0.8031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0800 2.3031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3746 3.0607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6780 2.3183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6868 0.8183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3921 0.0607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9726 3.0759 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.6068 -1.4848 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3122 -2.2424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0088 -1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3209 -3.7423 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0263 -4.4999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7313 -3.2053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7839 -5.7946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2683 -5.2575 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6061 1.0357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0357 -0.6061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6061 -1.0357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4858 2.2646 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2789 3.4575 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0859 2.2505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2031 -1.1696 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7140 1.7027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2567 1.7117 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6199 -1.2530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3990 -2.5844 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0372 2.8970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3676 4.2607 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7295 0.2244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3956 -0.5393 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6495 -2.0787 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3044 -2.5992 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3373 -2.1696 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2491 -3.5083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2660 -6.0976 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3899 -6.8303 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8196 -5.1885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5714 -4.7396 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3040 -5.8636 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9653 -5.7754 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1150 -3.6968 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1577 -4.2907 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 23 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 16 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 2 0 0 0 0 14 56 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 21 45 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 30 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 56 57 1 0 0 0 0 M END