D0WO8A Wcorina 10100417213D 1 1.00000 0.00000 CORINA evaluation license 3.40 0067 02.08.2006 41 44 0 1 0 0 0 0 0999 V2000 -2.5982 -2.2754 4.9068 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -4.7979 4.9302 0.1445 Cl 0 0 0 0 0 0 0 0 0 0 0 0 7.9995 1.4287 -0.0631 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.9793 -1.4441 -0.0689 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6088 3.0366 0.0466 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0177 1.4686 0.0262 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1231 0.8441 -0.0137 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0039 -0.0102 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4799 -0.3399 -0.0354 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6503 -0.5736 1.2231 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2660 1.8708 0.0214 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1513 2.2895 0.0542 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5186 0.9829 -0.0258 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4674 -1.6841 1.1222 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4268 0.0112 2.4556 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0093 3.6704 0.0873 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4196 1.7244 0.0432 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3297 -0.1400 0.0656 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0910 2.2429 -0.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0659 -2.2070 2.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0241 -0.5114 3.5872 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1293 4.4781 0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5364 2.5365 0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8468 -1.6191 3.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7038 -0.0008 0.0535 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4655 2.3771 -0.1467 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3922 3.9122 0.1097 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2720 1.2568 -0.0493 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4904 -0.3718 -0.9104 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6384 -2.1430 0.1596 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2149 0.8763 2.5344 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0239 4.1125 0.0918 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5327 0.6507 0.0127 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8866 -1.1216 0.1465 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4619 3.1175 -0.2111 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7048 -3.0742 2.1739 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8494 -0.0545 4.5501 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0195 5.5521 0.1411 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5231 2.0975 0.0621 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3352 -0.8740 0.1246 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9113 3.3571 -0.2316 H 0 0 0 0 0 0 0 0 0 0 0 0 1 24 1 0 0 0 0 2 27 1 0 0 0 0 3 28 1 0 0 0 0 4 9 2 0 0 0 0 5 11 2 0 0 0 0 6 8 1 0 0 0 0 6 11 1 0 0 0 0 6 12 1 0 0 0 0 7 9 1 0 0 0 0 7 11 1 0 0 0 0 7 13 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 29 1 0 0 0 0 10 14 2 0 0 0 0 10 15 1 0 0 0 0 12 16 2 0 0 0 0 12 17 1 0 0 0 0 13 18 2 0 0 0 0 13 19 1 0 0 0 0 14 20 1 0 0 0 0 14 30 1 0 0 0 0 15 21 2 0 0 0 0 15 31 1 0 0 0 0 16 22 1 0 0 0 0 16 32 1 0 0 0 0 17 23 2 0 0 0 0 17 33 1 0 0 0 0 18 25 1 0 0 0 0 18 34 1 0 0 0 0 19 26 2 0 0 0 0 19 35 1 0 0 0 0 20 24 2 0 0 0 0 20 36 1 0 0 0 0 21 24 1 0 0 0 0 21 37 1 0 0 0 0 22 27 2 0 0 0 0 22 38 1 0 0 0 0 23 27 1 0 0 0 0 23 39 1 0 0 0 0 25 28 2 0 0 0 0 25 40 1 0 0 0 0 26 28 1 0 0 0 0 26 41 1 0 0 0 0 M END $$$$