D0Q3VS Wcorina 10100417213D 1 1.00000 0.00000 CORINA evaluation license 3.40 0067 02.08.2006 21 22 0 0 0 0 0 0 0999 V2000 4.2275 2.5498 -0.0240 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.7039 7.7306 0.0176 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.0179 1.4682 0.0101 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1641 0.9764 -0.0134 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0021 -0.0041 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5070 -0.3378 -0.0141 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2777 1.9169 0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6307 3.3542 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9703 3.7467 -0.0066 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6259 4.3221 0.0126 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2930 5.0897 -0.0029 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9603 5.6598 0.0162 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2912 6.0444 0.0119 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4699 -0.4000 0.9012 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4871 -0.3903 -0.8922 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7654 -0.8935 -0.9156 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7825 -0.9031 0.8762 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8119 2.0254 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4122 4.0240 0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3289 5.3952 -0.0111 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1829 6.4095 0.0229 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 2 13 1 0 0 0 0 3 5 1 0 0 0 0 3 7 1 0 0 0 0 3 18 1 0 0 0 0 4 6 1 0 0 0 0 4 7 2 0 0 0 0 5 6 1 0 0 0 0 5 14 1 0 0 0 0 5 15 1 0 0 0 0 6 16 1 0 0 0 0 6 17 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 9 11 1 0 0 0 0 10 12 2 0 0 0 0 10 19 1 0 0 0 0 11 13 2 0 0 0 0 11 20 1 0 0 0 0 12 13 1 0 0 0 0 12 21 1 0 0 0 0 M END $$$$