# generated using pymatgen data_Al2FeO4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.74644890 _cell_length_b 5.74645025 _cell_length_c 5.74644069 _cell_angle_alpha 60.00001660 _cell_angle_beta 60.00005728 _cell_angle_gamma 59.99990624 _symmetry_Int_Tables_number 1 _chemical_formula_structural Al2FeO4 _chemical_formula_sum 'Al4 Fe2 O8' _cell_volume 134.17854118 _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 Al Al0 1 0.49999762 0.49999762 0.49999762 1.0 Al Al1 1 0.49999762 0.49999762 0.00000714 1.0 Al Al2 1 0.49999762 0.00000714 0.49999762 1.0 Al Al3 1 0.00000714 0.49999762 0.49999762 1.0 Fe Fe4 1 0.87500000 0.87500000 0.87500000 1.0 Fe Fe5 1 0.12500000 0.12500000 0.12500000 1.0 O O6 1 0.73476777 0.73476577 0.73476677 1.0 O O7 1 0.26523959 0.26524059 0.70428122 1.0 O O8 1 0.26523859 0.70428122 0.26524059 1.0 O O9 1 0.70428122 0.26523859 0.26523959 1.0 O O10 1 0.73476677 0.29570068 0.73476777 1.0 O O11 1 0.29570068 0.73476677 0.73476577 1.0 O O12 1 0.26524059 0.26523959 0.26523859 1.0 O O13 1 0.73476577 0.73476777 0.29569968 1.0