MMs01791039 MOE2007 2D CORINA 3.40 0006 02.08.2006 78 82 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 1.3242 0.7047 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3242 -0.4953 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5342 -0.1819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9819 0.2106 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.6713 -0.9485 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5783 1.5869 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.1783 2.6262 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0716 1.4450 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.2307 1.1344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3980 -0.0191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7744 -0.6155 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1065 -0.7819 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0642 2.5696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5270 3.3970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9972 3.0997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4749 1.6778 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4824 0.5532 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0121 0.8504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9452 1.3805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4229 -0.0414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8931 -0.3386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8857 0.7860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4080 2.2079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9377 2.5052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8748 2.9117 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.0263 2.0632 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3991 3.1850 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2648 2.2035 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2256 1.6035 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0192 2.9790 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8677 3.8275 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3215 4.4397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8161 4.5671 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2161 5.6063 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5916 5.8511 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8674 7.1646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6429 8.4486 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3677 7.1942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4013 2.3960 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5972 3.3015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4110 4.7899 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9793 2.7185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3857 4.3148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7624 4.1209 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5637 1.0593 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0593 -0.5637 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5637 -1.0593 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6272 -0.9676 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0982 -1.2411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0402 3.1954 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5026 3.6866 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9654 4.5140 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5031 4.0227 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0272 4.2993 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1838 3.2785 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5063 -0.0726 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0439 -0.5639 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9821 -0.3492 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8255 0.6716 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6288 -0.9411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2752 -1.4762 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0619 0.5482 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2020 3.1076 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5556 3.6427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8692 4.5887 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3334 5.0396 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3914 8.3940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8321 7.2179 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3558 6.5944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4456 3.8242 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0849 2.2522 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5129 1.6128 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2896 3.5255 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1751 5.2187 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4819 5.1041 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9552 3.9896 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5344 2.2723 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 46 1 0 0 0 0 1 47 1 0 0 0 0 1 48 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 29 1 0 0 0 0 4 5 1 0 0 0 0 4 49 1 0 0 0 0 4 50 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 13 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 26 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 14 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 14 51 1 0 0 0 0 14 52 1 0 0 0 0 14 78 1 0 0 0 0 15 16 1 0 0 0 0 15 53 1 0 0 0 0 15 54 1 0 0 0 0 15 78 1 0 0 0 0 16 17 1 0 0 0 0 16 55 1 0 0 0 0 16 56 1 0 0 0 0 17 18 1 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 57 1 0 0 0 0 18 58 1 0 0 0 0 19 59 1 0 0 0 0 19 60 1 0 0 0 0 19 78 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 61 1 0 0 0 0 22 23 1 0 0 0 0 22 62 1 0 0 0 0 23 24 2 0 0 0 0 23 63 1 0 0 0 0 24 25 1 0 0 0 0 24 64 1 0 0 0 0 25 65 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 45 1 0 0 0 0 28 29 1 0 0 0 0 28 34 1 0 0 0 0 28 44 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 31 40 1 0 0 0 0 33 34 1 0 0 0 0 33 66 1 0 0 0 0 33 67 1 0 0 0 0 34 35 1 0 0 0 0 34 36 1 0 0 0 0 36 37 1 0 0 0 0 37 38 2 0 0 0 0 37 39 1 0 0 0 0 39 68 1 0 0 0 0 39 69 1 0 0 0 0 39 70 1 0 0 0 0 40 41 1 0 0 0 0 41 42 2 0 0 0 0 41 43 1 0 0 0 0 43 71 1 0 0 0 0 43 72 1 0 0 0 0 43 73 1 0 0 0 0 44 74 1 0 0 0 0 44 75 1 0 0 0 0 44 76 1 0 0 0 0 45 77 1 0 0 0 0 M END