D0K7PS Wcorina 10100417203D 1 1.00000 0.00000 CORINA evaluation license 3.40 0067 02.08.2006 30 31 0 0 0 0 0 0 0999 V2000 -2.2479 7.7277 -2.1399 Br 0 0 0 0 0 0 0 0 0 0 0 0 -3.8947 2.9175 4.8575 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.1423 1.3975 0.0788 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0974 -0.0223 0.0398 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0176 2.2086 0.2057 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4519 2.8904 -3.2948 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0487 1.3655 -2.4970 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9002 1.8797 -1.3124 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1981 1.8252 1.4231 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2126 3.2192 -1.5044 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3974 3.5796 -2.1657 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3569 4.2096 -1.0379 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1462 0.9242 1.8707 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0741 3.0594 2.0334 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7000 4.9317 -2.3519 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6695 5.5396 -1.2289 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9746 1.2591 2.9252 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9013 3.3951 3.0885 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8364 5.8995 -1.8868 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8545 2.4962 3.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3157 2.5397 -2.6606 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1259 1.2267 -1.9931 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5538 3.9379 -0.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2398 -0.0414 1.3962 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3304 3.7612 1.6859 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6093 5.2174 -2.8599 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0012 6.3055 -0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7158 0.5554 3.2743 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8044 4.3593 3.5652 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0229 2.1728 -3.6016 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 1 0 0 0 0 2 20 1 0 0 0 0 3 4 2 0 0 0 0 3 5 2 0 0 0 0 3 8 1 0 0 0 0 3 9 1 0 0 0 0 6 21 1 0 0 0 0 6 30 1 0 0 0 0 7 21 2 0 0 0 0 8 10 1 0 0 0 0 8 22 1 0 0 0 0 9 13 2 0 0 0 0 9 14 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 11 15 1 0 0 0 0 11 21 1 0 0 0 0 12 16 2 0 0 0 0 12 23 1 0 0 0 0 13 17 1 0 0 0 0 13 24 1 0 0 0 0 14 18 2 0 0 0 0 14 25 1 0 0 0 0 15 19 2 0 0 0 0 15 26 1 0 0 0 0 16 19 1 0 0 0 0 16 27 1 0 0 0 0 17 20 2 0 0 0 0 17 28 1 0 0 0 0 18 20 1 0 0 0 0 18 29 1 0 0 0 0 M END $$$$