# generated using pymatgen data_Li3V4FeO12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.73590452 _cell_length_b 7.74184931 _cell_length_c 10.23644211 _cell_angle_alpha 69.32341356 _cell_angle_beta 101.08325757 _cell_angle_gamma 73.85234659 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li3V4FeO12 _chemical_formula_sum 'Li6 V8 Fe2 O24' _cell_volume 521.38053687 _cell_formula_units_Z 2 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 0.27249300 0.10254500 0.37471700 1.0 Li Li1 1 0.76947900 0.10553000 0.87534700 1.0 Li Li2 1 0.88294200 0.24575200 0.12423600 1.0 Li Li3 1 0.38054500 0.24092500 0.62595400 1.0 Li Li4 1 0.60557200 0.76935600 0.37451400 1.0 Li Li5 1 0.10526700 0.76928300 0.87496800 1.0 V V6 1 0.47771400 0.19879000 0.08932000 1.0 V V7 1 0.95799700 0.60410300 0.15973100 1.0 V V8 1 0.54309600 0.39098500 0.34116000 1.0 V V9 1 0.51438800 0.81421200 0.90463300 1.0 V V10 1 0.98563000 0.20147700 0.59047600 1.0 V V11 1 0.46236300 0.61202500 0.66028700 1.0 V V12 1 0.03098400 0.39017600 0.84567000 1.0 V V13 1 0.01820400 0.79800800 0.40854400 1.0 Fe Fe14 1 0.71273700 0.91384500 0.63044200 1.0 Fe Fe15 1 0.20565100 0.91734400 0.11958200 1.0 O O16 1 0.92509200 0.02101800 0.70421500 1.0 O O17 1 0.42132100 0.01376100 0.20542400 1.0 O O18 1 0.02437700 0.77812600 0.04569700 1.0 O O19 1 0.53165400 0.78476400 0.54442100 1.0 O O20 1 0.17656100 0.10303600 0.54612700 1.0 O O21 1 0.67495100 0.10045700 0.05237400 1.0 O O22 1 0.10051500 0.36899700 0.20387900 1.0 O O23 1 0.59764100 0.37794300 0.69752000 1.0 O O24 1 0.48627200 0.21617700 0.46365200 1.0 O O25 1 0.98666600 0.19750500 0.97387100 1.0 O O26 1 0.57915300 0.98712600 0.77686200 1.0 O O27 1 0.07082900 0.97679900 0.28569600 1.0 O O28 1 0.78040800 0.36347100 0.42331000 1.0 O O29 1 0.28961400 0.34704700 0.92426700 1.0 O O30 1 0.96390800 0.64254500 0.32684000 1.0 O O31 1 0.47822300 0.63534600 0.82516200 1.0 O O32 1 0.53368200 0.35210100 0.17875900 1.0 O O33 1 0.04947300 0.34313900 0.67740500 1.0 O O34 1 0.72904500 0.62729500 0.07301600 1.0 O O35 1 0.21952800 0.64546700 0.57102000 1.0 O O36 1 0.40319400 0.62893400 0.29770000 1.0 O O37 1 0.91450400 0.64051100 0.79524200 1.0 O O38 1 0.31490700 0.87947100 0.95616400 1.0 O O39 1 0.82342200 0.89461000 0.45179500 1.0