s1110.mol corina 12080917213D 1 1.00000 0.00000 CORINA 3.46 0026 05.08.2008 13 14 0 0 0 0 0 0 0 0999 V2000 -0.0162 1.3429 0.0094 N 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 1.1745 2.0189 0.0017 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3190 1.3644 -0.0102 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3576 0.0777 -0.0164 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2612 -0.6452 -0.0113 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3455 -2.1498 -0.0192 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1225 3.7833 0.0076 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.0334 -0.6485 0.0071 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2664 2.0998 0.0314 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1799 3.2102 1.0446 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1578 3.9990 1.0957 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2173 3.3919 1.9377 N 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 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 2 6 1 0 0 0 0 6 7 1 0 0 0 0 3 8 1 0 0 0 0 2 9 2 0 0 0 0 1 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 8 12 1 0 0 0 0 11 13 1 0 0 0 0 M END $$$$