D0NV9C Wcorina 10100417223D 1 1.00000 0.00000 CORINA evaluation license 3.40 0067 02.08.2006 25 25 0 0 0 0 0 0 0999 V2000 -3.3416 3.1560 5.2170 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.0172 1.4168 0.0098 S 0 0 0 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 1.1617 2.2101 0.0028 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7653 2.5103 -3.7067 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3725 4.8747 -4.7831 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 -1.9117 4.7095 -3.4544 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9297 1.8941 1.4396 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1366 3.3017 -1.5741 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8430 1.0207 1.9999 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7279 3.1398 2.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5593 1.3949 3.1212 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4434 3.5147 3.1255 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3619 2.6434 3.6829 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6270 3.4775 -2.9882 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2609 1.2094 -1.9136 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8873 3.6790 -0.8796 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2072 3.8551 -1.4403 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9971 0.0459 1.5612 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0108 3.8201 1.5687 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2734 0.7127 3.5584 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2860 4.4881 3.5662 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8011 5.4831 -2.8797 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5500 5.7936 -5.0265 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 4 2 0 0 0 0 2 7 1 0 0 0 0 2 9 1 0 0 0 0 5 16 2 0 0 0 0 6 8 1 0 0 0 0 6 25 1 0 0 0 0 7 10 1 0 0 0 0 7 17 1 0 0 0 0 8 16 1 0 0 0 0 8 24 1 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 10 16 1 0 0 0 0 10 18 1 0 0 0 0 10 19 1 0 0 0 0 11 13 1 0 0 0 0 11 20 1 0 0 0 0 12 14 2 0 0 0 0 12 21 1 0 0 0 0 13 15 2 0 0 0 0 13 22 1 0 0 0 0 14 15 1 0 0 0 0 14 23 1 0 0 0 0 M END $$$$