m469-2.mol corina 12080917093D 1 1.00000 0.00000 CORINA 3.46 0026 05.08.2008 19 20 0 0 0 0 0 0 0 0999 V2000 -0.0168 1.3893 0.0097 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0021 -0.0041 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1579 -0.6589 -0.0127 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3080 -0.0229 -0.0181 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3632 1.3658 -0.0079 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1855 2.0842 0.0019 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7142 2.0291 -0.0005 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5940 3.4921 -0.4241 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5017 4.1562 0.4221 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1481 3.5873 -0.0015 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2690 -0.7565 0.0108 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3956 -0.1223 0.0255 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2527 -2.2634 0.0025 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6141 -0.8436 0.0339 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7791 -0.0163 0.0501 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8075 -0.9479 -0.0380 S 0 0 0 0 0 0 0 0 0 0 0 0 4.7605 -0.0835 0.5653 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4616 -2.1891 0.5612 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1774 -1.1726 -1.7996 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 2 3 1 0 0 0 3 4 2 0 0 0 4 5 1 0 0 0 5 6 2 0 0 0 6 1 1 0 0 0 5 7 1 0 0 0 7 8 1 0 0 0 8 9 1 0 0 0 9 10 1 0 0 0 10 6 1 0 0 0 2 11 1 0 0 0 11 12 2 0 0 0 11 13 1 0 0 0 12 14 1 0 0 0 14 15 1 0 0 0 4 16 1 0 0 0 16 17 2 0 0 0 16 18 2 0 0 0 16 19 1 0 0 0 M END $$$$