# generated using pymatgen data_Fe3O4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.07221623 _cell_length_b 6.08476958 _cell_length_c 6.04861865 _cell_angle_alpha 60.10092980 _cell_angle_beta 59.26280075 _cell_angle_gamma 59.66409828 _symmetry_Int_Tables_number 1 _chemical_formula_structural Fe3O4 _chemical_formula_sum 'Fe6 O8' _cell_volume 156.84709860 _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 0.86937100 0.88096200 0.86725400 1.0 Fe Fe1 1 0.00390200 0.49785800 0.49775400 1.0 Fe Fe2 1 0.50014700 0.49694600 0.49763900 1.0 Fe Fe3 1 0.13308700 0.11774300 0.13013300 1.0 Fe Fe4 1 0.50154000 0.99441700 0.50050700 1.0 Fe Fe5 1 0.50198900 0.49926100 0.99622700 1.0 O O6 1 0.73027600 0.75277300 0.26492400 1.0 O O7 1 0.73565000 0.24768300 0.26938000 1.0 O O8 1 0.25625100 0.24322800 0.26838500 1.0 O O9 1 0.26312300 0.75588100 0.73322700 1.0 O O10 1 0.26675200 0.73342700 0.25998400 1.0 O O11 1 0.73973400 0.75999900 0.73395800 1.0 O O12 1 0.26694300 0.25248800 0.73641800 1.0 O O13 1 0.73123600 0.26733400 0.74421000 1.0