D01PWK Wcorina 10100417223D 1 1.00000 0.00000 CORINA evaluation license 3.40 0067 02.08.2006 36 38 0 1 0 0 0 0 0999 V2000 -6.1931 0.5353 -3.5891 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.5736 0.6239 3.1063 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.6364 3.4855 4.9252 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.0929 1.4626 0.1673 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0863 0.0428 0.2258 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0874 2.2537 0.1811 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2150 4.6317 -2.0176 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4736 4.8479 0.0711 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9393 1.8842 -1.2073 N 0 0 3 0 0 0 0 0 0 0 0 0 -2.5433 3.2194 -0.0484 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6099 3.1999 -1.1719 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0994 2.0240 1.5075 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0126 1.0046 -2.3766 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1929 2.8387 1.2475 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2713 0.1789 -2.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7918 1.6516 2.8008 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5814 4.2868 -0.9936 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9716 3.2884 2.3129 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5719 2.0969 3.8538 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6604 2.9193 3.6059 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4392 0.6496 -2.8754 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2560 -1.0520 -1.6764 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5946 -0.1085 -2.8106 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4102 -1.8097 -1.6114 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5803 -1.3372 -2.1758 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1546 3.3578 -2.1027 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0240 1.6075 -3.2846 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1453 0.3445 -2.3896 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4532 3.5133 -0.2116 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8213 3.9282 2.1258 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3334 1.8045 4.8658 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4499 1.6093 -3.3707 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3420 -1.4216 -1.2357 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3977 -2.7713 -1.1198 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8593 5.3343 -1.8553 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4820 -1.9293 -2.1249 H 0 0 0 0 0 0 0 0 0 0 0 0 1 23 1 0 0 0 0 2 16 1 0 0 0 0 3 20 1 0 0 0 0 4 5 2 0 0 0 0 4 6 2 0 0 0 0 4 9 1 0 0 0 0 4 12 1 0 0 0 0 7 17 1 0 0 0 0 7 35 1 0 0 0 0 8 17 2 0 0 0 0 9 11 1 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 10 29 1 0 0 0 0 11 17 1 0 0 0 0 11 26 1 0 0 0 0 12 14 2 0 0 0 0 12 16 1 0 0 0 0 13 15 1 0 0 0 0 13 27 1 0 0 0 0 13 28 1 0 0 0 0 14 18 1 0 0 0 0 15 21 2 0 0 0 0 15 22 1 0 0 0 0 16 19 2 0 0 0 0 18 20 2 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 21 23 1 0 0 0 0 21 32 1 0 0 0 0 22 24 2 0 0 0 0 22 33 1 0 0 0 0 23 25 2 0 0 0 0 24 25 1 0 0 0 0 24 34 1 0 0 0 0 25 36 1 0 0 0 0 M END $$$$