# generated using pymatgen data_Fe5O8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.41966600 _cell_length_b 8.41966600 _cell_length_c 8.41966600 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Fe5O8 _chemical_formula_sum 'Fe20 O32' _cell_volume 596.87665263 _cell_formula_units_Z 4 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 Fe Fe0 1 0.99692000 0.99692000 0.99692000 1.0 Fe Fe1 1 0.00308000 0.49692000 0.50308000 1.0 Fe Fe2 1 0.13523300 0.11476700 0.62500000 1.0 Fe Fe3 1 0.11476700 0.62500000 0.13523300 1.0 Fe Fe4 1 0.12500000 0.36476700 0.88523300 1.0 Fe Fe5 1 0.25308000 0.25308000 0.25308000 1.0 Fe Fe6 1 0.24692000 0.74692000 0.75308000 1.0 Fe Fe7 1 0.38523300 0.37500000 0.63523300 1.0 Fe Fe8 1 0.37500000 0.63523300 0.38523300 1.0 Fe Fe9 1 0.36476700 0.88523300 0.12500000 1.0 Fe Fe10 1 0.50308000 0.00308000 0.49692000 1.0 Fe Fe11 1 0.49692000 0.50308000 0.00308000 1.0 Fe Fe12 1 0.62500000 0.13523300 0.11476700 1.0 Fe Fe13 1 0.63523300 0.38523300 0.37500000 1.0 Fe Fe14 1 0.61476700 0.87500000 0.86476700 1.0 Fe Fe15 1 0.75308000 0.24692000 0.74692000 1.0 Fe Fe16 1 0.74692000 0.75308000 0.24692000 1.0 Fe Fe17 1 0.88523300 0.12500000 0.36476700 1.0 Fe Fe18 1 0.86476700 0.61476700 0.87500000 1.0 Fe Fe19 1 0.87500000 0.86476700 0.61476700 1.0 O O20 1 0.14399800 0.38246800 0.11813200 1.0 O O21 1 0.14225400 0.35774600 0.64225400 1.0 O O22 1 0.13186800 0.86753200 0.10600200 1.0 O O23 1 0.11813200 0.14399800 0.38246800 1.0 O O24 1 0.11753200 0.88186800 0.64399800 1.0 O O25 1 0.10600200 0.13186800 0.86753200 1.0 O O26 1 0.13246800 0.60600200 0.36813200 1.0 O O27 1 0.10774600 0.60774600 0.89225400 1.0 O O28 1 0.38246800 0.11813200 0.14399800 1.0 O O29 1 0.39225400 0.39225400 0.39225400 1.0 O O30 1 0.36813200 0.13246800 0.60600200 1.0 O O31 1 0.36753200 0.39399800 0.86813200 1.0 O O32 1 0.35774600 0.64225400 0.14225400 1.0 O O33 1 0.39399800 0.86813200 0.36753200 1.0 O O34 1 0.35600200 0.61753200 0.61813200 1.0 O O35 1 0.38186800 0.85600200 0.88246800 1.0 O O36 1 0.64225400 0.14225400 0.35774600 1.0 O O37 1 0.60600200 0.36813200 0.13246800 1.0 O O38 1 0.61813200 0.35600200 0.61753200 1.0 O O39 1 0.61753200 0.61813200 0.35600200 1.0 O O40 1 0.64399800 0.11753200 0.88186800 1.0 O O41 1 0.63186800 0.63246800 0.89399800 1.0 O O42 1 0.60774600 0.89225400 0.10774600 1.0 O O43 1 0.63246800 0.89399800 0.63186800 1.0 O O44 1 0.86753200 0.10600200 0.13186800 1.0 O O45 1 0.89225400 0.10774600 0.60774600 1.0 O O46 1 0.86813200 0.36753200 0.39399800 1.0 O O47 1 0.88186800 0.64399800 0.11753200 1.0 O O48 1 0.89399800 0.63186800 0.63246800 1.0 O O49 1 0.88246800 0.38186800 0.85600200 1.0 O O50 1 0.85600200 0.88246800 0.38186800 1.0 O O51 1 0.85774600 0.85774600 0.85774600 1.0