D05CQR Wcorina 10100417223D 1 1.00000 0.00000 CORINA evaluation license 3.40 0067 02.08.2006 27 27 0 0 0 0 0 0 0999 V2000 -2.3527 -0.0034 -0.4481 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.3220 1.6757 0.1136 S 0 0 0 0 0 0 0 0 0 0 0 0 0.4710 0.2637 0.1704 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4556 2.5299 0.0460 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8347 4.7083 -4.2318 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8373 4.3077 -5.6299 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1068 3.7998 -6.8055 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8187 4.5573 -7.9444 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5289 1.9623 -1.4024 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0361 2.8814 -2.3055 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7109 3.1072 -3.5053 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6877 1.2605 -1.6876 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8295 2.2463 1.3939 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8815 2.4011 -3.7849 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3615 1.4802 -2.8774 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1872 4.0928 -4.4783 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1895 4.2225 -6.7819 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8701 3.4254 -2.0837 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3795 2.1047 2.3765 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0462 3.3037 1.2425 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7547 1.6733 1.3319 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4080 2.5720 -4.7122 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2648 0.9296 -3.0948 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5236 3.4681 -5.9949 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6121 3.8309 -7.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7408 4.8580 -7.9276 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3443 4.4949 -8.7881 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 0 0 0 2 3 2 0 0 0 0 2 4 2 0 0 0 0 2 9 1 0 0 0 0 2 13 1 0 0 0 0 5 16 2 0 0 0 0 6 16 1 0 0 0 0 6 17 2 0 0 0 0 7 17 1 0 0 0 0 7 24 1 0 0 0 0 7 25 1 0 0 0 0 8 17 1 0 0 0 0 8 26 1 0 0 0 0 8 27 1 0 0 0 0 9 10 1 0 0 0 0 9 12 2 0 0 0 0 10 11 2 0 0 0 0 10 18 1 0 0 0 0 11 14 1 0 0 0 0 11 16 1 0 0 0 0 12 15 1 0 0 0 0 13 19 1 0 0 0 0 13 20 1 0 0 0 0 13 21 1 0 0 0 0 14 15 2 0 0 0 0 14 22 1 0 0 0 0 15 23 1 0 0 0 0 M END $$$$