D0A6WQ Wcorina 11010620303D 1 1.00000 0.00000 0 CORINA evaluation license 3.40 0067 02.08.2006 47 51 0 0 0 999 V2000 -0.9897 2.2902 0.9356 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3012 2.3264 0.0021 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0225 1.8097 0.0120 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.5315 -0.6533 0.4439 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0319 -1.8546 0.3770 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7575 -1.7787 0.2171 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4007 -0.5264 0.1765 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5129 0.2139 0.3188 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0021 -0.0041 0.0020 C 0 0 1 0 0 0 0 0 0 0 0 0 0.5201 -0.4567 -1.2162 F 0 0 0 0 0 0 0 0 0 0 0 0 0.8805 -0.5085 1.1487 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8991 -0.1331 1.0511 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7676 -5.5843 4.5983 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5804 -5.0562 5.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2035 -3.7418 6.0346 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5760 -4.7991 3.4827 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1936 -3.4652 3.6358 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0052 -2.9306 4.9221 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6362 -1.6137 4.7639 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9120 -2.3738 2.6969 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5853 -1.2964 3.4269 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2782 -0.1224 2.5169 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8646 -2.0512 1.2194 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2422 -7.2441 4.4148 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.6723 2.2493 -1.5657 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0358 2.4042 -1.7329 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5456 2.7490 -2.9707 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6919 2.9394 -4.0412 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3284 2.7854 -3.8737 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1817 2.4448 -2.6349 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9859 -0.3009 0.6222 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7340 -5.6816 6.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0625 -3.3415 7.0277 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7210 -5.2128 2.4957 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4407 -1.0000 5.4892 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7498 0.7842 2.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7993 0.0179 2.4303 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0512 -2.4416 0.7754 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7377 -2.4629 0.7133 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7027 2.2555 -0.8966 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6109 2.8694 -3.1015 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0903 3.2081 -5.0084 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3385 2.9338 -4.7102 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2470 2.3245 -2.5041 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4616 -0.2162 -0.3549 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4805 -1.0812 1.2006 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0674 0.6494 1.1497 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 2 0 0 0 0 2 3 2 0 0 0 0 3 9 1 0 0 0 0 3 25 1 0 0 0 0 4 8 1 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 7 9 1 0 0 0 0 7 8 1 0 0 0 0 9 11 1 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 11 22 1 0 0 0 0 11 23 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 13 24 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 15 18 2 0 0 0 0 15 33 1 0 0 0 0 16 17 2 0 0 0 0 16 34 1 0 0 0 0 17 20 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 21 1 0 0 0 0 19 35 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 22 36 1 0 0 0 0 22 37 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 25 26 2 0 0 0 0 25 30 1 0 0 0 0 26 27 1 0 0 0 0 26 40 1 0 0 0 0 27 28 2 0 0 0 0 27 41 1 0 0 0 0 28 29 1 0 0 0 0 28 42 1 0 0 0 0 29 30 2 0 0 0 0 29 43 1 0 0 0 0 30 44 1 0 0 0 0 31 45 1 0 0 0 0 31 46 1 0 0 0 0 31 47 1 0 0 0 0 M END $$$$