D0OG3K Wcorina 11010620253D 1 1.00000 0.00000 0 CORINA evaluation license 3.40 0067 02.08.2006 27 27 0 0 0 999 V2000 0.4671 1.5060 0.3372 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2790 0.1307 0.2643 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7499 2.0301 0.3887 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6380 2.3620 0.3529 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3754 -0.7235 0.2427 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3286 -0.5215 0.2007 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.8529 1.1750 0.3672 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5145 3.6299 -0.0871 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6608 -0.2056 0.2939 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1821 -2.1060 0.1698 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1790 1.7130 0.4197 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7152 4.5147 -0.1616 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5726 4.0527 -0.4228 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1282 -2.9443 0.6374 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2309 2.1398 0.4614 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5920 5.7805 -0.6009 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8013 4.0923 0.1738 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9808 -4.4179 0.4459 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1001 -2.5015 1.2141 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9253 -5.2549 0.9127 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0098 -4.8603 -0.1303 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8954 3.0988 0.4451 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4936 2.0435 0.6804 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5122 -0.8698 0.2774 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3671 -2.4620 -0.2173 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3973 6.3149 -0.6314 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7860 -6.2003 0.7648 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 1 0 0 0 0 1 4 1 0 0 0 0 2 5 1 0 0 0 0 2 6 1 0 0 0 0 3 7 2 0 0 0 0 3 22 1 0 0 0 0 4 8 1 0 0 0 0 4 23 1 0 0 0 0 5 9 2 0 0 0 0 5 10 1 0 0 0 0 7 11 1 0 0 0 0 7 9 1 0 0 0 0 8 12 1 0 0 0 0 8 13 2 0 0 0 0 9 24 1 0 0 0 0 10 14 1 0 0 0 0 10 25 1 0 0 0 0 11 15 3 0 0 0 0 12 16 1 0 0 0 0 12 17 2 0 0 0 0 14 18 1 0 0 0 0 14 19 2 0 0 0 0 16 26 1 0 0 0 0 18 20 1 0 0 0 0 18 21 2 0 0 0 0 20 27 1 0 0 0 0 M END $$$$