D0Q5BU Wcorina 11010620233D 1 1.00000 0.00000 0 CORINA evaluation license 3.40 0067 02.08.2006 58 60 0 1 0 999 V2000 -0.0077 -0.1928 0.2111 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.1913 -1.5631 0.5694 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0541 -0.0593 1.5897 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4977 0.0997 0.1727 C 0 0 2 0 0 0 0 0 0 0 0 0 1.5697 -1.3582 2.1828 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4846 -2.0334 1.6515 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6148 0.6849 3.7437 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2387 0.3168 2.6383 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3263 0.9611 4.8633 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5183 -0.0615 1.5411 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9228 1.1927 5.8019 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6183 0.0656 -1.1678 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2334 -1.8753 3.2821 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6040 0.3148 2.5930 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0629 -3.2268 2.2281 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7174 1.4358 -0.2840 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6809 0.7061 1.2502 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8136 -3.0668 3.8556 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2948 0.0041 1.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4870 -3.5860 4.9671 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7229 -3.7421 3.3246 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0155 -0.2321 -1.1334 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4321 1.4375 -1.5217 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7846 0.0691 1.5568 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4695 1.6851 -2.9286 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6216 -0.3264 -2.4241 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4758 -1.0621 1.9487 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4607 1.2584 1.3592 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8273 1.3180 1.5589 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8423 -1.0025 2.1485 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5176 0.1884 1.9567 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7136 0.7710 2.2084 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9918 -0.6041 -0.4972 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9763 -0.3317 0.7298 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1295 -0.5698 -1.9064 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0817 -1.3493 3.6947 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1160 0.5190 3.3911 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7857 -3.7525 1.8157 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6491 1.6926 -0.3151 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2366 0.5258 2.2291 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5387 1.7508 0.9735 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7470 0.4822 1.2882 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0189 -0.9981 1.0109 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0071 0.7281 0.5767 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2484 -3.1128 5.3375 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1924 -4.4192 5.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3916 -4.6688 3.7692 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4562 1.4310 -3.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2653 2.7389 -3.1176 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2842 1.0741 -3.4252 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9433 -0.8372 -3.1076 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5524 -0.8885 -2.3482 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8314 0.6746 -2.8009 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9481 -1.9923 2.0991 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9214 2.1410 1.0484 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3557 2.2471 1.4038 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3823 -1.8862 2.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5853 0.2348 2.1124 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 12 1 0 0 0 0 1 17 1 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 10 1 0 0 0 0 3 32 1 0 0 0 0 4 16 1 0 0 0 0 4 33 1 0 0 0 0 5 13 2 0 0 0 0 5 6 1 0 0 0 0 6 15 2 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 8 10 1 0 0 0 0 8 14 1 0 0 0 0 9 11 3 0 0 0 0 10 34 1 0 0 0 0 12 22 1 0 0 0 0 12 23 1 0 0 0 0 12 35 1 0 0 0 0 13 18 1 0 0 0 0 13 36 1 0 0 0 0 14 19 1 0 0 0 0 14 37 1 0 0 0 0 15 21 1 0 0 0 0 15 38 1 0 0 0 0 16 39 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 20 1 0 0 0 0 18 21 2 0 0 0 0 19 24 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 21 47 1 0 0 0 0 22 26 1 0 0 0 0 23 25 1 0 0 0 0 24 27 2 0 0 0 0 24 28 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 27 30 1 0 0 0 0 27 54 1 0 0 0 0 28 29 2 0 0 0 0 28 55 1 0 0 0 0 29 31 1 0 0 0 0 29 56 1 0 0 0 0 30 31 2 0 0 0 0 30 57 1 0 0 0 0 31 58 1 0 0 0 0 M END $$$$