D0X9FO Wcorina 11010620253D 1 1.00000 0.00000 0 CORINA evaluation license 3.40 0067 02.08.2006 37 38 0 0 0 999 V2000 -0.0181 1.4804 0.0102 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0043 0.0013 -0.1159 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2576 -2.8477 -1.0318 N 0 3 0 0 0 0 0 0 0 0 0 0 1.1602 2.1257 0.1094 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1979 -0.6743 0.1623 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2754 0.0365 0.5831 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4499 1.3498 0.0539 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2928 2.2221 0.0203 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1247 -0.7089 -0.5024 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0576 -2.0840 -0.6219 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6272 5.2605 -2.5147 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6453 4.6892 -2.5225 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3013 -2.2640 -1.2630 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.2012 -4.0597 -1.1379 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1516 2.4283 1.4869 S 0 0 0 0 0 0 0 0 0 0 0 0 1.2539 -2.0502 0.0311 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1267 -2.7501 -0.3594 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7817 2.7375 -1.1250 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3730 3.9490 -2.5326 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9142 1.2486 -1.4005 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5147 2.0842 0.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0669 0.4587 -1.4682 F 0 0 0 0 0 0 0 0 0 0 0 0 4.7237 1.3842 0.7980 F 0 0 0 0 0 0 0 0 0 0 0 0 -3.0479 3.4743 -1.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1801 3.1989 0.2283 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0493 -0.1900 -0.7079 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1752 -2.5764 0.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1712 -3.8245 -0.4607 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2951 2.6207 -1.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4597 3.0866 -3.1936 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5759 4.6013 -2.8891 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1269 0.7950 -2.0025 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1342 2.2458 -1.7818 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6516 3.0886 0.4702 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1943 2.1486 1.9109 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8450 2.8219 -0.7585 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9613 4.3366 -0.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 2 0 0 0 0 1 8 1 0 0 0 0 2 5 2 0 0 0 0 2 9 1 0 0 0 0 3 10 1 0 0 0 0 3 13 1 0 0 0 0 3 14 2 0 0 0 0 4 7 1 0 0 0 0 4 25 1 0 0 0 0 5 16 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 7 20 1 0 0 0 0 7 21 1 0 0 0 0 8 15 2 0 0 0 0 8 18 1 0 0 0 0 9 10 2 0 0 0 0 9 26 1 0 0 0 0 10 17 1 0 0 0 0 11 12 3 0 0 0 0 12 19 1 0 0 0 0 16 17 2 0 0 0 0 16 27 1 0 0 0 0 17 28 1 0 0 0 0 18 24 1 0 0 0 0 18 29 1 0 0 0 0 19 24 1 0 0 0 0 19 30 1 0 0 0 0 19 31 1 0 0 0 0 20 22 1 0 0 0 0 20 32 1 0 0 0 0 20 33 1 0 0 0 0 21 23 1 0 0 0 0 21 34 1 0 0 0 0 21 35 1 0 0 0 0 24 36 1 0 0 0 0 24 37 1 0 0 0 0 M CHG 2 3 1 13 -1 M END $$$$