s1157.mol corina 12080917223D 1 1.00000 0.00000 CORINA 3.46 0026 05.08.2008 18 20 0 0 0 0 0 0 0 0999 V2000 -0.0161 1.3395 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 1.1784 2.0135 0.0016 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3604 1.2946 0.0303 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2997 -0.0285 0.0453 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1510 3.7743 -0.0593 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.0431 -0.6315 -0.0286 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2056 2.0779 0.0449 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6905 2.0029 0.0438 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1748 -0.6500 0.0280 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2599 4.0596 0.9692 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2886 3.1890 0.9065 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4932 3.3993 1.7359 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5732 4.5012 2.5898 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7007 4.6915 3.3613 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7510 3.7933 3.2906 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6783 2.6992 2.4466 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5591 2.5000 1.6652 C 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 3 6 1 0 0 0 0 2 7 2 0 0 0 0 1 8 1 0 0 0 0 4 9 1 0 0 0 0 5 10 2 0 0 0 0 2 10 1 0 0 0 0 11 12 2 0 0 0 0 6 11 1 0 0 0 0 8 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 13 18 1 0 0 0 0 M END $$$$