# generated using pymatgen data_Li35(RuO4)12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.32545929 _cell_length_b 10.32545929 _cell_length_c 9.88080740 _cell_angle_alpha 69.05802372 _cell_angle_beta 69.05802372 _cell_angle_gamma 70.50730924 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li35(RuO4)12 _chemical_formula_sum 'Li35 Ru12 O48' _cell_volume 892.88831711 _cell_formula_units_Z 1 loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 'x, y, z' loop_ _atom_site_type_symbol _atom_site_label _atom_site_symmetry_multiplicity _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Li Li0 1 0.90039900 0.76583000 0.16689600 1.0 Li Li1 1 0.76564800 0.90036600 0.66763500 1.0 Li Li2 1 0.94029500 0.56172700 0.00072200 1.0 Li Li3 1 0.56036300 0.93954100 0.49956200 1.0 Li Li4 1 0.73223900 0.59349400 0.83520300 1.0 Li Li5 1 0.96700600 0.35944600 0.83771500 1.0 Li Li6 1 0.47396500 0.85921400 0.83321100 1.0 Li Li7 1 0.85894300 0.47382800 0.33300700 1.0 Li Li8 1 0.59912800 0.73379500 0.33237100 1.0 Li Li9 1 0.35988800 0.97342400 0.33428600 1.0 Li Li10 1 0.89101500 0.27248100 0.16389900 1.0 Li Li11 1 0.39369400 0.77255700 0.16689900 1.0 Li Li12 1 0.77209900 0.39219000 0.67304200 1.0 Li Li13 1 0.27330100 0.89380400 0.66595300 1.0 Li Li14 1 0.92725200 0.07274800 0.00000000 1.0 Li Li15 1 0.19309500 0.80690500 0.00000000 1.0 Li Li16 1 0.43615700 0.56384300 0.00000000 1.0 Li Li17 1 0.06799100 0.93200900 0.50000000 1.0 Li Li18 1 0.80681000 0.19319000 0.50000000 1.0 Li Li19 1 0.56745800 0.43254200 0.50000000 1.0 Li Li20 1 0.30771300 0.69228700 0.50000000 1.0 Li Li21 1 0.72751900 0.10898500 0.83610100 1.0 Li Li22 1 0.22744300 0.60630600 0.83310100 1.0 Li Li23 1 0.10619600 0.72669900 0.33404700 1.0 Li Li24 1 0.60781000 0.22790100 0.32695800 1.0 Li Li25 1 0.64055400 0.03299400 0.16228500 1.0 Li Li26 1 0.40650600 0.26776100 0.16479700 1.0 Li Li27 1 0.14078600 0.52603500 0.16678900 1.0 Li Li28 1 0.52617200 0.14105700 0.66699300 1.0 Li Li29 1 0.02657600 0.64011200 0.66571400 1.0 Li Li30 1 0.26620500 0.40087200 0.66762900 1.0 Li Li31 1 0.43827300 0.05970500 0.99927800 1.0 Li Li32 1 0.06045900 0.43963700 0.50043800 1.0 Li Li33 1 0.23417000 0.09960100 0.83310400 1.0 Li Li34 1 0.09963400 0.23435200 0.33236500 1.0 Ru Ru35 1 0.98813200 0.84549500 0.83310200 1.0 Ru Ru36 1 0.84614700 0.98628200 0.33586700 1.0 Ru Ru37 1 0.67855000 0.82082200 0.00069700 1.0 Ru Ru38 1 0.82114600 0.67758100 0.50097400 1.0 Ru Ru39 1 0.65564600 0.51004500 0.16447700 1.0 Ru Ru40 1 0.51065300 0.65544500 0.66571200 1.0 Ru Ru41 1 0.48995500 0.34435400 0.83552300 1.0 Ru Ru42 1 0.34455500 0.48934700 0.33428800 1.0 Ru Ru43 1 0.17917800 0.32145000 0.99930300 1.0 Ru Ru44 1 0.32241900 0.17885400 0.49902600 1.0 Ru Ru45 1 0.15450500 0.01186800 0.16689800 1.0 Ru Ru46 1 0.01371700 0.15385300 0.66413300 1.0 O O47 1 0.81331400 0.92621600 0.99354800 1.0 O O48 1 0.85314800 0.74140000 0.84009000 1.0 O O49 1 0.92735000 0.80987600 0.49636300 1.0 O O50 1 0.60662600 0.96553200 0.84305800 1.0 O O51 1 0.74162100 0.85164000 0.34164900 1.0 O O52 1 0.96657100 0.60617900 0.34306100 1.0 O O53 1 0.53328500 0.89327700 0.15705600 1.0 O O54 1 0.75843700 0.64792400 0.16038100 1.0 O O55 1 0.89255000 0.53137100 0.65858300 1.0 O O56 1 0.57392500 0.68578800 0.00645600 1.0 O O57 1 0.64671400 0.75908300 0.65974300 1.0 O O58 1 0.80517800 0.44661100 0.01021000 1.0 O O59 1 0.29989200 0.94025200 0.00925400 1.0 O O60 1 0.68596200 0.57451700 0.50589200 1.0 O O61 1 0.87205900 0.22357600 0.81900400 1.0 O O62 1 0.36627900 0.72772200 0.82314100 1.0 O O63 1 0.94132400 0.29940600 0.50747100 1.0 O O64 1 0.43954600 0.80171900 0.50718900 1.0 O O65 1 0.09373400 0.97954400 0.82549000 1.0 O O66 1 0.59001100 0.48411000 0.82260300 1.0 O O67 1 0.22688900 0.86648700 0.32374700 1.0 O O68 1 0.72656300 0.36595800 0.32306900 1.0 O O69 1 0.98122000 0.09194700 0.32761800 1.0 O O70 1 0.47939200 0.59297200 0.32719900 1.0 O O71 1 0.51589000 0.40998900 0.17739700 1.0 O O72 1 0.02045600 0.90626600 0.17451000 1.0 O O73 1 0.77642400 0.12794100 0.18099600 1.0 O O74 1 0.27227800 0.63372100 0.17685900 1.0 O O75 1 0.90805300 0.01878000 0.67238200 1.0 O O76 1 0.40702800 0.52060800 0.67280100 1.0 O O77 1 0.05974800 0.70010800 0.99074600 1.0 O O78 1 0.55338900 0.19482200 0.98979000 1.0 O O79 1 0.13351300 0.77311100 0.67625300 1.0 O O80 1 0.63404200 0.27343700 0.67693100 1.0 O O81 1 0.31421200 0.42607500 0.99354400 1.0 O O82 1 0.70059400 0.05867600 0.49252900 1.0 O O83 1 0.19828100 0.56045400 0.49281100 1.0 O O84 1 0.35207600 0.24156300 0.83961900 1.0 O O85 1 0.42548300 0.31403800 0.49410800 1.0 O O86 1 0.10672300 0.46671500 0.84294400 1.0 O O87 1 0.24091700 0.35328600 0.34025700 1.0 O O88 1 0.46862900 0.10745000 0.34141700 1.0 O O89 1 0.03446800 0.39337400 0.15694200 1.0 O O90 1 0.25860000 0.14685200 0.15991000 1.0 O O91 1 0.39382100 0.03342900 0.65693900 1.0 O O92 1 0.07378400 0.18668600 0.00645200 1.0 O O93 1 0.14836000 0.25837900 0.65835100 1.0 O O94 1 0.19012400 0.07265000 0.50363700 1.0