D04TTP Wcorina 10100417213D 1 1.00000 0.00000 CORINA evaluation license 3.40 0067 02.08.2006 22 24 0 0 0 0 0 0 0999 V2000 0.0255 0.2345 2.8401 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.0288 0.2713 -2.8342 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.0164 1.3561 0.0095 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0624 -4.1463 0.2320 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1168 -5.4310 3.6912 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0419 -2.0948 1.1848 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0675 -3.1162 2.2429 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0397 -2.7873 -0.0361 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0793 -4.3644 1.5964 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0229 -0.7006 1.1965 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0179 -2.0704 -1.2282 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0810 -3.0816 3.6370 C 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 -0.0005 -0.6917 -1.2071 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1044 -5.5143 2.3769 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1055 -4.2737 4.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0621 -4.8445 -0.4413 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0161 -2.5948 -2.1723 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0722 -2.1391 4.1643 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1149 -6.4840 1.9016 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1165 -4.2615 5.4089 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8616 1.7614 0.0033 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 1 0 0 0 0 2 14 1 0 0 0 0 3 13 1 0 0 0 0 3 22 1 0 0 0 0 4 8 1 0 0 0 0 4 9 1 0 0 0 0 4 17 1 0 0 0 0 5 15 2 0 0 0 0 5 16 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 10 2 0 0 0 0 7 9 2 0 0 0 0 7 12 1 0 0 0 0 8 11 2 0 0 0 0 9 15 1 0 0 0 0 10 13 1 0 0 0 0 11 14 1 0 0 0 0 11 18 1 0 0 0 0 12 16 2 0 0 0 0 12 19 1 0 0 0 0 13 14 2 0 0 0 0 15 20 1 0 0 0 0 16 21 1 0 0 0 0 M END $$$$