MMs01959557 MOE2007 2D CORINA 3.40 0006 02.08.2006 58 60 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 1.3020 -0.7449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3079 -2.2449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6099 -2.9898 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9059 -2.2346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9000 -0.7347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0204 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1902 1.5204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8882 2.2653 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4863 2.2755 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.4863 1.0755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4804 3.7755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1784 4.5204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1725 6.0204 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.8705 6.7653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7883 1.5307 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0843 2.2858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0784 3.7857 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3863 1.5409 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.3863 2.7409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6824 2.2960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9844 1.5511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2805 2.3062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5824 1.5613 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5883 0.0613 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2923 -0.6938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9903 0.0511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6942 -0.7040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6158 -4.4897 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5959 1.0416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0416 0.5959 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5959 -1.0416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2710 -2.8490 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9475 -2.8306 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5933 1.2102 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2377 -0.5755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6630 3.5718 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8864 4.9048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7724 3.3912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9958 4.7241 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4664 7.8069 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8289 7.3612 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2746 5.7237 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7930 0.3307 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9074 3.2122 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4501 3.2183 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2757 3.5062 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6193 2.1654 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6299 -0.5346 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2970 -1.8938 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4692 -1.6202 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9265 -1.6263 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4158 -4.4945 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6205 -5.6897 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8158 -4.4850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 0.0409 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.3554 -0.5632 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 37 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 13 1 0 0 0 0 11 17 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 57 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 27 2 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 28 29 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 29 57 1 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 30 56 1 0 0 0 0 57 58 1 0 0 0 0 M END