# generated using pymatgen data_Li5Fe5O12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.09979000 _cell_length_b 9.11940366 _cell_length_c 9.46223146 _cell_angle_alpha 83.31254423 _cell_angle_beta 85.29542585 _cell_angle_gamma 85.92095673 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li5Fe5O12 _chemical_formula_sum 'Li10 Fe10 O24' _cell_volume 434.74998384 _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 0.26841100 0.08409500 0.00018200 1.0 Li Li1 1 0.38299500 0.53511200 0.24460600 1.0 Li Li2 1 0.35109800 0.85945500 0.26245000 1.0 Li Li3 1 0.51557100 0.33360800 0.49379300 1.0 Li Li4 1 0.47305900 0.67436700 0.49659600 1.0 Li Li5 1 0.76523200 0.57516900 0.00213400 1.0 Li Li6 1 0.73621800 0.91739400 0.00867800 1.0 Li Li7 1 0.89124300 0.03394300 0.25367900 1.0 Li Li8 1 0.90469400 0.38592600 0.23940700 1.0 Li Li9 1 0.99221500 0.17036800 0.49186000 1.0 Fe Fe10 1 0.00542900 0.50681100 0.49811900 1.0 Fe Fe11 1 0.13068500 0.29018800 0.75105000 1.0 Fe Fe12 1 0.10608300 0.96368600 0.74572400 1.0 Fe Fe13 1 0.25101300 0.74135000 0.00309000 1.0 Fe Fe14 1 0.36980200 0.21268700 0.24760100 1.0 Fe Fe15 1 0.51876400 0.00016700 0.49626700 1.0 Fe Fe16 1 0.59021900 0.46271500 0.75435000 1.0 Fe Fe17 1 0.76017100 0.24527300 0.00676800 1.0 Fe Fe18 1 0.64456100 0.79099600 0.74757200 1.0 Fe Fe19 1 0.85904400 0.71334800 0.25286600 1.0 O O20 1 0.06946300 0.21516700 0.13706900 1.0 O O21 1 0.06294200 0.59032800 0.11943700 1.0 O O22 1 0.05073100 0.86805100 0.13601800 1.0 O O23 1 0.15569100 0.66506900 0.38423200 1.0 O O24 1 0.23817100 0.04200900 0.36412700 1.0 O O25 1 0.20038100 0.35435000 0.36822600 1.0 O O26 1 0.26834300 0.13112200 0.63405700 1.0 O O27 1 0.30046500 0.46322800 0.62560800 1.0 O O28 1 0.35272800 0.84446100 0.61588000 1.0 O O29 1 0.58140600 0.08907800 0.11069300 1.0 O O30 1 0.44284200 0.29523800 0.85946700 1.0 O O31 1 0.57942600 0.36603900 0.13852100 1.0 O O32 1 0.40288900 0.91000000 0.88654800 1.0 O O33 1 0.46600800 0.62232800 0.87320900 1.0 O O34 1 0.55959400 0.72396900 0.12937100 1.0 O O35 1 0.66209500 0.16664700 0.38674300 1.0 O O36 1 0.72342200 0.53646600 0.36686400 1.0 O O37 1 0.67638500 0.85040200 0.36421000 1.0 O O38 1 0.76210200 0.62153800 0.63838400 1.0 O O39 1 0.83754400 0.34388800 0.61352300 1.0 O O40 1 0.79879800 0.96834700 0.62786800 1.0 O O41 1 0.88779900 0.40940800 0.88250000 1.0 O O42 1 0.96222600 0.11982000 0.87898200 1.0 O O43 1 0.94527900 0.79740400 0.86488400 1.0