MMs00645788 MOE2007 2D CORINA 3.40 0006 02.08.2006 59 63 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 0.2912 -1.4715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6528 -2.1008 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4750 -3.5902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6760 -4.4889 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0548 -3.8981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2326 -2.4087 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0316 -1.5100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2093 -0.0206 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6113 -1.8179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8123 -2.7166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6345 -4.2060 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1911 -2.1258 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.3689 -0.6364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7476 -0.0457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9486 -0.9443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7709 -2.4338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3921 -3.0245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2143 -4.5139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4153 -5.4126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7941 -4.8218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9719 -3.3324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0036 -3.8814 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.7281 -2.5719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2175 -2.3942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8083 -1.0154 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1162 -3.5952 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6056 -3.4174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1964 -2.0386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6858 -1.8609 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5845 -3.0619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9937 -4.4406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5043 -4.6184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9135 -5.9972 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8122 -7.1982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1772 0.2330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2330 1.1772 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1772 -0.2330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0156 -4.6171 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9544 -0.8137 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4862 -0.9966 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1707 -0.7033 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0950 0.5319 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0907 0.9585 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6225 0.7757 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4898 0.1267 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0974 -1.2913 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1113 -4.9866 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2731 -6.6042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7549 -5.5408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0749 -2.8598 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6436 -4.6982 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4774 -1.0778 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1584 -0.7579 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7760 -2.9196 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7126 -5.4014 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7730 -6.4792 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5311 -8.1590 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8514 -7.9171 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 24 2 0 0 0 0 3 4 2 0 0 0 0 3 8 1 0 0 0 0 4 5 1 0 0 0 0 4 23 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 8 9 2 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 16 46 1 0 0 0 0 16 47 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 19 20 1 0 0 0 0 19 48 1 0 0 0 0 20 21 2 0 0 0 0 20 49 1 0 0 0 0 21 22 1 0 0 0 0 21 50 1 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 24 25 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 52 1 0 0 0 0 28 29 1 0 0 0 0 28 33 2 0 0 0 0 29 30 2 0 0 0 0 29 53 1 0 0 0 0 30 31 1 0 0 0 0 30 54 1 0 0 0 0 31 32 2 0 0 0 0 31 55 1 0 0 0 0 32 33 1 0 0 0 0 32 56 1 0 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 35 57 1 0 0 0 0 35 58 1 0 0 0 0 35 59 1 0 0 0 0 M END