MMs01368355 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 45 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 2.5981 0.0088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2914 2.2544 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2914 3.4544 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0102 3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3067 2.2456 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6082 2.9912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6133 4.4912 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9047 2.2368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8996 0.7368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1961 -0.0176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4977 0.7279 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5028 2.2279 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2063 2.9823 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2114 4.4823 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5130 5.2279 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5879 3.0088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8895 2.2632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1859 3.0176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1808 4.5176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8793 5.2632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5828 4.5088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6035 1.0372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0372 -0.6035 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6035 -1.0372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0016 -1.0324 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6393 -0.5876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1945 1.0501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7580 3.9218 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7846 3.9166 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3026 1.0456 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8584 0.1403 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1920 -1.2176 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5349 0.1244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5441 2.8244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9165 6.2692 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5542 5.8244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1094 4.1867 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8935 1.0632 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2272 2.4212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2180 5.1211 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8752 6.4632 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5415 5.1053 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2965 0.7544 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 44 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 2 44 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 17 1 0 0 0 0 3 44 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 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 14 2 0 0 0 0 10 11 2 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 12 13 2 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 43 1 0 0 0 0 M END