D0IX1I Wcorina 11010620243D 1 1.00000 0.00000 CORINA evaluation license 3.40 0067 02.08.2006 68 70 0 0 0 0 999 V2000 -0.0173 1.4248 0.0099 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0021 -0.0041 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2011 -0.6379 0.0101 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2590 -2.0287 0.0089 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2502 -4.1823 0.0009 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1124 -2.7600 0.0016 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4877 -2.6635 0.0157 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9733 -2.6604 0.0286 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.1693 -3.0192 -0.9818 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8936 -3.8559 0.9804 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2272 -4.6088 0.9523 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.1825 -5.7095 1.8983 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4048 -4.9971 -0.0505 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3571 -3.6500 1.3367 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.3606 -2.4576 0.3764 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0631 -1.7744 0.4450 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6613 -1.9229 0.0243 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6035 -0.5451 0.0281 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0619 -0.5437 -0.3578 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8518 0.2996 0.0455 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3733 0.0963 0.0252 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6985 -4.3805 1.2483 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8138 -3.4616 1.7512 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1678 -4.1441 1.5471 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6062 -3.1752 3.2397 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6255 -9.3142 1.5692 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.6656 -8.0786 2.3627 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.4011 -7.9809 3.2185 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3257 -9.1872 4.1566 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1703 -7.9638 2.3098 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7398 -6.8904 1.4387 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4009 -7.0007 0.2843 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5424 -8.0908 3.0101 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2025 -3.2958 2.3559 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0053 1.8021 0.0021 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5445 1.7859 -0.8732 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5275 1.7763 0.9067 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8017 -4.4935 -0.8863 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7377 -4.6430 -0.0052 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7915 -4.4954 0.8936 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5342 -3.7425 0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0920 -4.5224 0.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6954 -3.5034 1.9926 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5327 -2.8102 -0.6405 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1523 -1.7643 0.6603 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9950 -0.7969 -1.4159 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9776 0.0168 -0.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0060 0.6963 1.0489 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7382 1.1270 -0.6549 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3307 1.1754 0.0305 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8945 -4.6562 0.2121 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6638 -5.2798 1.8632 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7915 -2.5248 1.1944 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1901 -5.0809 2.1039 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9623 -3.4895 1.9053 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3157 -4.3482 0.4866 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4007 -2.5206 3.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6285 -4.1120 3.7965 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6416 -2.6890 3.3851 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8210 -9.3270 0.9604 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6405 -10.1277 2.1658 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4308 -7.0641 3.8073 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2960 -10.1041 3.5678 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4249 -9.1176 4.7663 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2025 -9.1994 4.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2240 -7.1044 1.6415 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2695 -7.8942 2.9195 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1406 -8.8806 1.7211 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 3 21 2 0 0 0 0 3 4 1 0 0 0 0 4 7 2 0 0 0 0 4 6 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 5 40 1 0 0 0 0 7 17 1 0 0 0 0 7 41 1 0 0 0 0 8 16 1 0 0 0 0 8 10 1 0 0 0 0 8 17 1 0 0 0 0 8 9 1 0 0 0 0 10 11 1 0 0 0 0 10 42 1 0 0 0 0 10 43 1 0 0 0 0 11 14 1 0 0 0 0 11 13 1 0 0 0 0 11 12 1 0 0 0 0 12 31 1 0 0 0 0 14 22 1 0 0 0 0 14 34 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 16 19 1 0 0 0 0 17 18 2 0 0 0 0 18 20 1 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 21 50 1 0 0 0 0 22 23 1 0 0 0 0 22 51 1 0 0 0 0 22 52 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 53 1 0 0 0 0 24 54 1 0 0 0 0 24 55 1 0 0 0 0 24 56 1 0 0 0 0 25 57 1 0 0 0 0 25 58 1 0 0 0 0 25 59 1 0 0 0 0 26 27 1 0 0 0 0 26 60 1 0 0 0 0 26 61 1 0 0 0 0 27 31 1 0 0 0 0 27 28 1 0 0 0 0 27 33 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 62 1 0 0 0 0 29 63 1 0 0 0 0 29 64 1 0 0 0 0 29 65 1 0 0 0 0 30 66 1 0 0 0 0 30 67 1 0 0 0 0 30 68 1 0 0 0 0 31 32 2 0 0 0 0 M END $$$$