s1133.mol corina 12080917223D 1 1.00000 0.00000 CORINA 3.46 0026 05.08.2008 19 20 0 0 0 0 0 0 0 0999 V2000 -0.0165 1.3634 0.0095 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0021 -0.0041 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3213 -0.3559 -0.0125 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0163 0.7578 -0.0131 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 1.7681 -0.0001 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0547 3.3597 0.0509 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0087 1.9780 0.0427 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7904 1.3263 0.0331 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6129 2.0595 0.0312 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6619 3.4462 0.0394 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8823 4.0929 0.0495 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9361 5.5990 0.0584 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7409 -0.1798 0.0247 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4387 -0.7200 1.2746 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4513 -0.7065 -1.2239 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4134 1.4209 0.0218 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2424 2.2398 0.0204 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7631 -0.6002 0.0061 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9684 -1.9948 -0.0269 S 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 1 5 2 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 9 8 2 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 6 11 1 0 0 0 0 11 12 1 0 0 0 0 8 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 9 16 1 0 0 0 0 16 17 1 0 0 0 0 1 17 1 0 0 0 0 2 18 1 0 0 0 0 3 19 1 0 0 0 0 M END $$$$