D0V1NK Wcorina 11010620323D 1 1.00000 0.00000 0 CORINA evaluation license 3.40 0067 02.08.2006 59 63 0 0 0 999 V2000 0.0189 1.3805 -0.0444 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0622 -0.0230 -0.0658 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2243 -0.6526 -0.0547 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1871 2.0845 -0.0121 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3774 1.4017 -0.0012 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3780 0.0314 -0.0229 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7062 -0.3719 -0.0047 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4925 0.7727 0.0279 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7103 1.8272 0.0293 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1720 3.4646 0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3317 -2.1564 -0.0208 Br 0 0 0 0 0 0 0 0 0 0 0 0 -1.1168 -0.7498 -0.0983 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0742 -2.2140 -0.1206 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.9593 -2.7428 1.3105 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9148 -4.2720 1.2871 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1958 -4.8097 0.6460 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.3107 -4.2809 -0.7851 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3551 -2.7517 -0.7617 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1531 -6.2779 0.6236 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7914 4.1544 1.0551 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8924 5.5392 1.0122 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5045 6.2177 2.0477 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0171 5.5200 3.1261 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9182 4.1414 3.1719 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3022 3.4572 2.1425 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7984 6.3895 4.4445 S 0 0 0 0 0 0 0 0 0 0 0 0 4.6706 5.4621 5.0755 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2397 7.6270 3.9031 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5493 6.7798 5.6243 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2657 5.8960 6.6487 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2857 6.2022 7.5743 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5896 7.3924 7.4758 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8738 8.2767 6.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8568 7.9724 5.5289 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9293 1.8973 -0.0579 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5721 0.7920 0.0485 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7315 3.9557 -0.7021 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9704 -0.2892 -0.1062 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2118 -2.5436 -0.7001 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0467 -2.3597 1.7672 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8216 -2.4132 1.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0525 -4.6016 0.7076 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8329 -4.6487 2.3066 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0581 -4.4801 1.2255 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4483 -4.6105 -1.3646 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2233 -4.6640 -1.2418 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2175 -2.4221 -0.1822 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4370 -2.3750 -1.7812 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9887 -6.6576 0.2045 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3274 -6.6084 0.1471 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4929 6.0846 0.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5834 7.2943 2.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3199 3.5996 4.0154 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2250 2.3805 2.1791 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8096 4.9661 6.7257 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0637 5.5114 8.3742 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1765 7.6313 8.1986 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3297 9.2064 6.3748 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0788 8.6632 4.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 2 0 0 0 0 1 35 1 0 0 0 0 2 12 1 0 0 0 0 2 3 2 0 0 0 0 3 6 1 0 0 0 0 4 10 1 0 0 0 0 4 5 1 0 0 0 0 5 9 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 2 0 0 0 0 8 36 1 0 0 0 0 10 20 1 0 0 0 0 10 37 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 13 18 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 18 47 1 0 0 0 0 18 48 1 0 0 0 0 19 49 1 0 0 0 0 19 50 1 0 0 0 0 20 21 2 0 0 0 0 20 25 1 0 0 0 0 21 22 1 0 0 0 0 21 51 1 0 0 0 0 22 23 2 0 0 0 0 22 52 1 0 0 0 0 23 24 1 0 0 0 0 23 26 1 0 0 0 0 24 25 2 0 0 0 0 24 53 1 0 0 0 0 25 54 1 0 0 0 0 26 27 2 0 0 0 0 26 28 2 0 0 0 0 26 29 1 0 0 0 0 29 30 2 0 0 0 0 29 34 1 0 0 0 0 30 31 1 0 0 0 0 30 55 1 0 0 0 0 31 32 2 0 0 0 0 31 56 1 0 0 0 0 32 33 1 0 0 0 0 32 57 1 0 0 0 0 33 34 2 0 0 0 0 33 58 1 0 0 0 0 34 59 1 0 0 0 0 M END $$$$