D0O4SE Wcorina 11010620313D 1 1.00000 0.00000 CORINA evaluation license 3.40 0067 02.08.2006 29 29 0 0 0 0 999 V2000 -0.0165 1.3646 0.0095 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0021 -0.0041 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1600 2.2631 0.0031 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.3107 1.7367 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0619 0.6255 0.0157 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0957 -2.2189 1.4024 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.2823 -0.4210 0.0115 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1929 -0.8572 -0.0142 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6212 -1.1625 1.4225 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2841 1.7945 -0.0101 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0038 3.4710 0.0111 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7445 -3.4758 0.8403 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1723 -1.4829 0.8381 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4173 -2.4472 3.1731 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7397 -1.8570 0.0075 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6521 -3.3317 3.3573 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6792 2.7518 0.0256 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9650 -1.7894 -0.5312 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0017 -0.3424 -0.5328 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8125 -1.6773 1.9412 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8491 -0.2303 1.9396 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5923 -1.4773 3.6386 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5557 -2.9243 3.6402 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8404 -2.2091 1.0342 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7027 -1.9301 -0.4978 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0068 -2.4703 -0.5166 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8453 -3.4689 4.4212 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4770 -4.3016 2.8917 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5136 -2.8546 2.8901 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 1 4 2 0 0 0 0 2 7 1 0 0 0 0 2 8 1 0 0 0 0 3 10 1 0 0 0 0 3 11 2 0 0 0 0 4 5 1 0 0 0 0 4 17 1 0 0 0 0 5 7 2 0 0 0 0 6 9 1 0 0 0 0 6 12 2 0 0 0 0 6 13 2 0 0 0 0 6 14 1 0 0 0 0 7 15 1 0 0 0 0 8 9 1 0 0 0 0 8 18 1 0 0 0 0 8 19 1 0 0 0 0 9 20 1 0 0 0 0 9 21 1 0 0 0 0 14 16 1 0 0 0 0 14 22 1 0 0 0 0 14 23 1 0 0 0 0 15 24 1 0 0 0 0 15 25 1 0 0 0 0 15 26 1 0 0 0 0 16 27 1 0 0 0 0 16 28 1 0 0 0 0 16 29 1 0 0 0 0 M CHG 2 3 1 10 -1 M END $$$$