D0SN7I Wcorina 10100417223D 1 1.00000 0.00000 CORINA evaluation license 3.40 0067 02.08.2006 46 48 0 0 0 0 0 0 0999 V2000 0.3583 3.9378 0.9395 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -7.4091 -0.9227 6.5407 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.1732 0.9277 0.0998 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.4817 -0.6063 9.4709 F 0 0 0 0 0 0 0 0 0 0 0 0 0.2792 -0.4715 0.3243 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2997 1.7908 0.0276 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8373 -0.5866 1.6734 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1127 1.3954 5.6418 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6489 1.1115 -1.3260 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1810 0.9931 -4.0587 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4727 0.3841 3.6972 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6847 -0.1736 5.6128 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5082 2.3378 -2.1258 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5343 0.0503 -1.8291 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1732 1.9426 -3.5679 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1567 -0.2498 -3.2836 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8573 1.5606 1.3813 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7522 0.7235 2.0275 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7685 2.8922 1.7461 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5650 1.2270 3.0404 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5756 3.3924 2.7527 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4746 2.5642 3.3975 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7343 0.5653 5.0069 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8737 -0.0729 6.9962 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1034 -0.3949 7.5558 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8301 0.3439 7.8123 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2863 -0.2940 8.9243 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0181 0.4428 9.1771 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2442 0.1275 9.7331 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4439 2.8965 -2.1071 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2956 2.9507 -1.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4086 -0.8484 -1.2253 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5706 0.3849 -1.7814 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8119 1.4773 -3.6019 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1769 2.8337 -4.1957 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8750 -0.9542 -3.7032 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1571 -0.6828 -3.3218 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1006 1.4083 -4.0561 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5031 4.4323 3.0347 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1037 2.9571 4.1826 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9125 -0.3295 3.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2426 -1.1671 2.1677 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2379 -0.7751 5.0903 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8716 0.5902 7.3799 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2061 0.7669 9.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3881 0.2059 10.8006 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 1 0 0 0 0 2 25 1 0 0 0 0 3 5 2 0 0 0 0 3 6 2 0 0 0 0 3 9 1 0 0 0 0 3 17 1 0 0 0 0 4 27 1 0 0 0 0 7 18 1 0 0 0 0 7 42 1 0 0 0 0 8 23 2 0 0 0 0 9 13 1 0 0 0 0 9 14 1 0 0 0 0 10 15 1 0 0 0 0 10 16 1 0 0 0 0 10 38 1 0 0 0 0 11 20 1 0 0 0 0 11 23 1 0 0 0 0 11 41 1 0 0 0 0 12 23 1 0 0 0 0 12 24 1 0 0 0 0 12 43 1 0 0 0 0 13 15 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 14 16 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 19 2 0 0 0 0 18 20 2 0 0 0 0 19 21 1 0 0 0 0 20 22 1 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 40 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 25 27 1 0 0 0 0 26 28 2 0 0 0 0 26 44 1 0 0 0 0 27 29 2 0 0 0 0 28 29 1 0 0 0 0 28 45 1 0 0 0 0 29 46 1 0 0 0 0 M END $$$$