# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'JSE' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Ru0 Ru -20.65900 14.33400 -26.26400 1.000 C1 C -20.50200 13.94900 -28.43000 1.000 C2 C -21.83900 14.03000 -28.09000 1.000 C3 C -22.07900 15.30500 -27.62100 1.000 C4 C -20.88800 16.01000 -27.63800 1.000 C5 C -19.90800 15.16400 -28.14200 1.000 C6 C -19.93800 12.59700 -25.09600 1.000 C7 C -19.05500 13.65800 -24.92000 1.000 C8 C -19.74600 14.70900 -24.34100 1.000 C9 C -21.04600 14.26900 -24.11000 1.000 C10 C -21.17400 12.98300 -24.63000 1.000 C11 C -19.17000 16.04100 -24.03900 1.000 C12 C -17.76900 16.31700 -24.57000 1.000 C13 C -17.26400 17.67800 -24.14600 1.000 C14 C -17.06500 17.72400 -22.65700 1.000 O15 O -19.81800 16.85300 -23.40500 1.000 O16 O -16.80700 16.70900 -22.01800 1.000 N17 N -17.20700 18.91800 -22.11300 1.000 C18 C -16.98500 19.11400 -20.71100 1.000 C19 C -18.15900 18.68600 -19.87600 1.000 N20 N -16.32700 20.90500 -19.14500 1.000 C21 C -16.66200 20.58400 -20.51800 1.000 O22 O -19.31700 19.01500 -20.10600 1.000 S23 S -15.25500 21.11900 -21.44500 1.000 C24 C -14.58400 22.21200 -20.19700 1.000 C25 C -15.59100 22.14300 -19.02500 1.000 C26 C -14.53100 23.64800 -20.72500 1.000 C27 C -13.18000 21.74300 -19.78200 1.000 C28 C -14.93400 22.26000 -17.69600 1.000 O29 O -14.64500 23.36200 -17.25200 1.000 O30 O -14.83000 21.18000 -16.94000 1.000 O31 O -17.91800 17.86900 -18.86000 1.000 H32 H -17.08400 15.54700 -24.18400 1.000 H33 H -17.79000 16.27200 -25.66900 1.000 H34 H -16.30500 17.88100 -24.64600 1.000 H35 H -17.99800 18.44400 -24.43700 1.000 H36 H -17.47200 19.69400 -22.68500 1.000 H37 H -16.10800 18.52800 -20.39900 1.000 H38 H -17.17400 20.98400 -18.61900 1.000 H39 H -17.51200 21.19300 -20.85800 1.000 H40 H -16.29100 22.98400 -19.13900 1.000 H41 H -14.11700 24.30900 -19.94900 1.000 H42 H -13.89100 23.68600 -21.61900 1.000 H43 H -15.54700 23.98000 -20.98600 1.000 H44 H -12.77800 22.42200 -19.01500 1.000 H45 H -13.24000 20.72300 -19.37400 1.000 H46 H -12.51700 21.74800 -20.66000 1.000 H47 H -14.51700 21.42600 -16.07700 1.000 H48 H -18.73600 17.64500 -18.43200 1.000