# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'CYR' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy O0 O 6.85900 0.89900 -1.41300 1.000 C1 C 6.51900 0.39100 -0.21800 1.000 O2 O 7.18200 0.64900 0.75900 1.000 C3 C 5.31100 -0.50200 -0.09500 1.000 N4 N 5.41200 -1.29500 1.13700 1.000 C5 C 4.04500 0.35600 -0.04700 1.000 C6 C 2.81400 -0.55100 -0.04700 1.000 C7 C 1.54800 0.30700 0.00100 1.000 N8 N 0.36800 -0.56200 0.00000 1.000 C9 C -0.89200 -0.01100 0.04000 1.000 N10 N -1.03600 1.28500 0.07800 1.000 S11 S -2.31000 -1.05600 0.03900 1.000 C12 C -3.62000 0.19200 0.09900 1.000 C13 C -4.98400 -0.50100 0.10700 1.000 C14 C -6.07500 0.53800 0.15700 1.000 O15 O -6.65700 0.85200 -0.85400 1.000 N16 N -5.13100 -1.30700 -1.11200 1.000 O17 O -6.39900 1.11600 1.32400 1.000 H18 H 7.63400 1.47200 -1.49200 1.000 H19 H 5.26400 -1.17100 -0.95400 1.000 H20 H 5.45300 -0.63900 1.90200 1.000 H21 H 4.54200 -1.79700 1.23200 1.000 H22 H 4.05100 0.96100 0.86000 1.000 H23 H 4.01600 1.00900 -0.91900 1.000 H24 H 2.80800 -1.15600 -0.95400 1.000 H25 H 2.84300 -1.20400 0.82500 1.000 H26 H 1.55300 0.91200 0.90800 1.000 H27 H 1.51800 0.96000 -0.87100 1.000 H28 H 0.47600 -1.52500 -0.02800 1.000 H29 H -1.92500 1.67300 0.10600 1.000 H30 H -0.25500 1.86000 0.07900 1.000 H31 H -3.51100 0.79000 1.00400 1.000 H32 H -3.54600 0.83900 -0.77500 1.000 H33 H -5.05800 -1.14700 0.98100 1.000 H34 H -6.07700 -1.65800 -1.11500 1.000 H35 H -5.05600 -0.67000 -1.89100 1.000 H36 H -7.09800 1.78300 1.35600 1.000