D06DTQ Wcorina 10100417253D 1 1.00000 0.00000 CORINA evaluation license 3.40 0067 02.08.2006 27 28 0 1 0 0 0 0 0999 V2000 -0.7880 -0.1315 -5.2733 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.0172 1.4168 0.0098 S 0 0 3 0 0 0 0 0 0 0 0 0 0.0021 -0.0041 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9452 0.3522 -0.9350 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8835 -1.3935 -1.3040 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6940 1.8365 -0.0043 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5365 1.8151 -1.6261 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6364 0.9153 -0.4689 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9971 1.2596 -0.4758 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1040 3.0756 0.4376 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4707 0.8608 -2.6235 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0151 3.0807 -1.9105 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3916 2.5112 -0.0211 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4482 3.4123 0.4294 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8784 1.1737 -3.9079 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4225 3.3938 -3.1936 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3518 2.4415 -4.1932 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2166 -0.3722 -0.9345 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3739 3.7882 0.7919 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1006 -0.1290 -2.4004 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0708 3.8248 -1.1297 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4373 2.7812 -0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7596 4.3860 0.7777 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7966 4.3824 -3.4152 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6702 2.6862 -5.1958 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6669 -0.5214 -1.2517 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8848 0.5928 -0.9387 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 2 7 1 0 0 0 0 4 9 1 0 0 0 0 4 26 1 0 0 0 0 4 27 1 0 0 0 0 5 18 3 0 0 0 0 6 8 1 0 0 0 0 6 10 2 0 0 0 0 7 11 2 0 0 0 0 7 12 1 0 0 0 0 8 9 2 0 0 0 0 8 18 1 0 0 0 0 9 13 1 0 0 0 0 10 14 1 0 0 0 0 10 19 1 0 0 0 0 11 15 1 0 0 0 0 11 20 1 0 0 0 0 12 16 2 0 0 0 0 12 21 1 0 0 0 0 13 14 2 0 0 0 0 13 22 1 0 0 0 0 14 23 1 0 0 0 0 15 17 2 0 0 0 0 16 17 1 0 0 0 0 16 24 1 0 0 0 0 17 25 1 0 0 0 0 M END $$$$