D06WSQ Wcorina 11010620233D 1 1.00000 0.00000 0 CORINA evaluation license 3.40 0067 02.08.2006 39 41 0 0 0 999 V2000 -0.0159 1.3782 0.0933 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0031 -0.0069 0.0148 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3612 -0.3894 -0.0912 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2970 1.8164 0.0360 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1131 0.7477 -0.0745 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0979 -0.8540 0.0364 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1653 2.1936 0.2053 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8743 -1.7774 -0.2007 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2739 1.6958 0.1347 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8360 -1.4728 0.1248 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6944 -2.1374 -1.2683 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5425 -2.7238 0.7667 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0334 3.5243 0.3904 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8323 -4.3672 -0.4048 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1694 -3.4294 -1.3653 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0227 -4.0132 0.6606 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4862 -6.1360 -0.5444 Br 0 0 0 0 0 0 0 0 0 0 0 0 -1.9554 -0.6337 -1.1373 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8647 -0.6896 1.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0313 -1.6810 1.2886 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1210 -1.6256 -1.1044 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2372 4.2872 0.4949 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5834 2.7425 0.0694 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1905 0.7868 -0.1388 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9575 -1.4065 -2.0187 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9109 -2.4486 1.5984 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8051 -3.7094 -2.1923 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7624 -4.7486 1.4075 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3434 0.3847 -1.1185 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3738 -0.7855 -2.0465 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2170 -0.8823 2.1352 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2514 0.3279 1.3374 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6358 -1.5240 2.1819 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6433 -2.6996 1.2853 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7357 -2.6426 -1.1772 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7904 -1.4285 -1.9417 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8191 4.1750 -0.4199 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8212 3.9300 1.3431 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9895 5.3385 0.6413 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 4 1 0 0 0 0 1 7 1 0 0 0 0 2 3 1 0 0 0 0 2 6 1 0 0 0 0 3 8 1 0 0 0 0 3 5 2 0 0 0 0 4 5 1 0 0 0 0 4 23 1 0 0 0 0 5 24 1 0 0 0 0 6 18 1 0 0 0 0 6 19 1 0 0 0 0 7 9 2 0 0 0 0 7 13 1 0 0 0 0 8 11 1 0 0 0 0 8 12 2 0 0 0 0 10 20 1 0 0 0 0 10 21 1 0 0 0 0 11 15 2 0 0 0 0 11 25 1 0 0 0 0 12 16 1 0 0 0 0 12 26 1 0 0 0 0 13 22 1 0 0 0 0 14 16 2 0 0 0 0 14 17 1 0 0 0 0 14 15 1 0 0 0 0 15 27 1 0 0 0 0 16 28 1 0 0 0 0 18 21 1 0 0 0 0 18 29 1 0 0 0 0 18 30 1 0 0 0 0 19 20 1 0 0 0 0 19 31 1 0 0 0 0 19 32 1 0 0 0 0 20 33 1 0 0 0 0 20 34 1 0 0 0 0 21 35 1 0 0 0 0 21 36 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 M END $$$$