# generated using pymatgen data_Fe3O4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.97179853 _cell_length_b 5.97028597 _cell_length_c 5.97006760 _cell_angle_alpha 60.01949761 _cell_angle_beta 59.99471754 _cell_angle_gamma 59.99050118 _symmetry_Int_Tables_number 1 _chemical_formula_structural Fe3O4 _chemical_formula_sum 'Fe6 O8' _cell_volume 150.51505689 _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 Fe Fe0 1 0.87486095 0.87520887 0.87514198 1.0 Fe Fe1 1 0.00003858 0.50002372 0.49986910 1.0 Fe Fe2 1 0.49975642 0.50027536 0.50007724 1.0 Fe Fe3 1 0.12485791 0.12520719 0.12513777 1.0 Fe Fe4 1 0.49994434 0.00008791 0.50023870 1.0 Fe Fe5 1 0.50012994 0.49994507 0.99995687 1.0 O O6 1 0.74366390 0.74325511 0.26918542 1.0 O O7 1 0.73084474 0.25610164 0.25633043 1.0 O O8 1 0.25678137 0.25611405 0.25624534 1.0 O O9 1 0.26904047 0.74363617 0.74363374 1.0 O O10 1 0.25623964 0.73108131 0.25626586 1.0 O O11 1 0.74374174 0.74358169 0.74374672 1.0 O O12 1 0.25635678 0.25630637 0.73097179 1.0 O O13 1 0.74374521 0.26917553 0.74319803 1.0