MMs00889554 MOE2007 2D CORINA 3.40 0006 02.08.2006 64 66 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 1.2995 -0.7491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0018 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8976 -0.7474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1962 0.0035 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1951 1.5035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8956 2.2526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8946 3.7526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5950 4.5018 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4957 -0.7456 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.2448 0.5539 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7466 -2.0452 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7952 -1.4947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7963 -2.9947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0958 -3.7439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3943 -2.9930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3933 -1.4930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0938 -0.7439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6918 -0.7421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9914 -1.4912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9924 -2.9912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2919 -3.7403 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6939 -3.7421 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6947 -4.9421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6908 0.7579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3913 1.5070 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9894 1.5088 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9884 3.0088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2869 3.7596 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5864 3.0105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8850 3.7614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8839 5.2614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5844 6.0105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2859 5.2596 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5993 1.0396 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0396 0.5993 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5993 -1.0396 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5288 -1.6689 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0715 -1.6679 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8261 0.9205 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9834 0.4616 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1269 -1.6671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6696 -1.6661 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3770 1.2959 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6048 2.6314 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6908 1.6887 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7137 2.4602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0765 3.5451 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3042 4.8805 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1943 5.5414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5554 5.1011 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9957 3.4621 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7574 -3.5954 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0966 -4.9439 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0930 0.4561 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0302 -0.8905 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0290 0.9095 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8067 2.7996 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5772 4.1361 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5872 1.8105 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.9246 3.1621 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.9228 5.8621 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5836 7.2105 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2462 5.8589 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 38 1 0 0 0 0 2 39 1 0 0 0 0 3 4 1 0 0 0 0 3 40 1 0 0 0 0 3 41 1 0 0 0 0 4 5 1 0 0 0 0 4 42 1 0 0 0 0 4 43 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 44 1 0 0 0 0 6 45 1 0 0 0 0 7 8 1 0 0 0 0 7 46 1 0 0 0 0 7 47 1 0 0 0 0 8 9 1 0 0 0 0 8 48 1 0 0 0 0 8 49 1 0 0 0 0 9 50 1 0 0 0 0 9 51 1 0 0 0 0 9 52 1 0 0 0 0 10 11 2 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 53 1 0 0 0 0 15 16 1 0 0 0 0 15 54 1 0 0 0 0 16 17 2 0 0 0 0 16 23 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 55 1 0 0 0 0 19 20 2 0 0 0 0 19 25 1 0 0 0 0 20 21 1 0 0 0 0 20 56 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 57 1 0 0 0 0 28 29 1 0 0 0 0 28 58 1 0 0 0 0 28 59 1 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 30 60 1 0 0 0 0 31 32 1 0 0 0 0 31 61 1 0 0 0 0 32 33 2 0 0 0 0 32 62 1 0 0 0 0 33 34 1 0 0 0 0 33 63 1 0 0 0 0 34 64 1 0 0 0 0 M END