MMs03867593 MOE2007 2D CORINA 3.40 0006 02.08.2006 76 78 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 0.7517 -1.2981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0033 -2.5981 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5967 -1.5588 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4967 -2.6000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2450 -3.9000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2483 -1.3019 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7483 -1.3038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5000 -0.0058 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.1000 -1.0450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9920 0.1491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3057 1.6160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0076 2.3676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8916 1.3653 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7550 -3.8962 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0066 -5.1961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7583 -6.4942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2583 -6.4923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0100 -7.7904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2616 -9.0904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7616 -9.0923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 -7.7942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0133 -10.3885 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2649 -11.6885 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2550 -3.8942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0033 -2.5942 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0066 -5.1923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5066 -5.1904 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.2583 -6.4885 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2550 -3.8904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7550 -3.8885 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5066 -5.1866 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5033 -2.5885 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0033 -2.5866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7517 -1.2866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2517 -1.2847 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0033 -2.5827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2550 -3.8827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7550 -3.8846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5033 -2.5808 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2516 -1.2808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0385 0.6013 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6013 1.0385 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0385 -0.6013 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6699 -0.5256 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6719 -2.0682 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6497 -0.2619 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5384 -2.4853 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8754 -1.7157 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9904 -1.0509 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1852 0.0222 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4465 1.2437 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7952 2.7116 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7142 3.3375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1169 3.1717 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9136 -4.4260 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9116 -5.9687 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5576 -5.9723 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2100 -7.7889 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1630 -10.1323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1900 -7.7958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2249 -11.0898 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6663 -12.7285 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3049 -12.2871 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8795 -5.6042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2165 -6.3738 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1268 -3.4814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4618 -2.7084 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9020 -1.5500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1503 -0.2481 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8503 -0.2447 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8563 -4.9212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1563 -4.9246 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2916 -1.8795 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8503 -0.2408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2117 -0.6821 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 42 1 0 0 0 0 1 43 1 0 0 0 0 1 44 1 0 0 0 0 2 3 1 0 0 0 0 2 45 1 0 0 0 0 2 46 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 15 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 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 10 1 0 0 0 0 9 11 1 0 0 0 0 9 14 1 0 0 0 0 11 12 1 0 0 0 0 11 50 1 0 0 0 0 11 51 1 0 0 0 0 12 13 1 0 0 0 0 12 52 1 0 0 0 0 12 53 1 0 0 0 0 13 14 1 0 0 0 0 13 54 1 0 0 0 0 13 55 1 0 0 0 0 15 16 1 0 0 0 0 15 25 1 0 0 0 0 16 17 1 0 0 0 0 16 56 1 0 0 0 0 16 57 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 58 1 0 0 0 0 19 20 1 0 0 0 0 19 59 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 60 1 0 0 0 0 22 61 1 0 0 0 0 23 24 1 0 0 0 0 24 62 1 0 0 0 0 24 63 1 0 0 0 0 24 64 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 65 1 0 0 0 0 27 66 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 31 1 0 0 0 0 30 67 1 0 0 0 0 30 68 1 0 0 0 0 31 32 2 0 0 0 0 31 33 1 0 0 0 0 33 34 1 0 0 0 0 33 69 1 0 0 0 0 34 35 1 0 0 0 0 34 39 2 0 0 0 0 35 36 2 0 0 0 0 35 70 1 0 0 0 0 36 37 1 0 0 0 0 36 71 1 0 0 0 0 37 38 2 0 0 0 0 37 40 1 0 0 0 0 38 39 1 0 0 0 0 38 72 1 0 0 0 0 39 73 1 0 0 0 0 40 41 1 0 0 0 0 41 74 1 0 0 0 0 41 75 1 0 0 0 0 41 76 1 0 0 0 0 M END