s1064.mol corina 12080917213D 1 1.00000 0.00000 CORINA 3.46 0026 05.08.2008 28 30 0 0 0 0 0 0 0 0999 V2000 -0.0025 1.4099 -0.0425 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0071 0.0376 -0.2642 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1890 2.0768 0.2162 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3776 1.3746 0.2523 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3831 0.0096 0.0314 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1992 -0.6577 -0.2265 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6600 -0.7398 0.0704 N 0 3 0 0 0 0 0 0 0 0 0 0 1.1841 3.5387 0.4525 N 0 3 0 0 0 0 0 0 0 0 0 0 -8.8616 -0.9435 -2.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9466 0.1022 -2.5182 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6493 2.7309 -1.9461 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2979 1.7833 -3.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4243 1.0190 -3.4836 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2089 0.0000 -0.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0103 -0.7015 -0.7035 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2058 1.3859 -0.6397 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0150 2.0705 -0.4867 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8092 1.3655 -0.4433 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8170 -0.0272 -0.5555 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3789 -0.6754 -0.8660 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.3813 2.0713 -0.7045 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2045 2.1168 -0.0855 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4159 1.4302 -0.2404 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5345 2.0881 -0.2803 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7034 -0.1537 0.2970 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6666 -1.9422 -0.1240 O 0 5 0 0 0 0 0 0 0 0 0 0 2.0925 4.2279 0.0241 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2718 4.0520 1.0751 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 2 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 2 6 2 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 3 8 1 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 10 13 1 0 0 0 0 12 13 1 0 0 0 0 14 15 1 0 0 0 0 14 16 2 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 15 19 2 0 0 0 0 18 19 1 0 0 0 0 14 20 1 0 0 0 0 16 21 1 0 0 0 0 9 20 1 0 0 0 0 11 21 1 0 0 0 0 1 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 18 24 1 0 0 0 0 7 25 2 0 0 0 0 7 26 1 0 0 0 0 8 27 2 0 0 0 0 8 28 1 0 0 0 0 M CHG 4 7 1 8 1 26 -1 28 -1 M END $$$$