# generated using pymatgen data_Na4FeO5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.57103400 _cell_length_b 7.45686071 _cell_length_c 14.89018041 _cell_angle_alpha 89.95002851 _cell_angle_beta 89.99996438 _cell_angle_gamma 89.99999231 _symmetry_Int_Tables_number 1 _chemical_formula_structural Na4FeO5 _chemical_formula_sum 'Na16 Fe4 O20' _cell_volume 507.54000203 _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 Na Na0 1 0.50000100 0.29173100 0.05283400 1.0 Na Na1 1 0.50000200 0.29155100 0.55225300 1.0 Na Na2 1 0.00000200 0.79103300 0.30224200 1.0 Na Na3 1 0.99999200 0.79141600 0.80273600 1.0 Na Na4 1 0.99999400 0.39411700 0.89561400 1.0 Na Na5 1 0.99999800 0.39446400 0.39535500 1.0 Na Na6 1 0.50000200 0.89392800 0.14595800 1.0 Na Na7 1 0.49999900 0.89427200 0.64580600 1.0 Na Na8 1 0.99999800 0.60550000 0.10442300 1.0 Na Na9 1 0.99999300 0.60602600 0.60408400 1.0 Na Na10 1 0.49999900 0.10558400 0.35430400 1.0 Na Na11 1 0.50000300 0.10483900 0.85440300 1.0 Na Na12 1 0.50000000 0.70848700 0.94770800 1.0 Na Na13 1 0.50000100 0.70870800 0.44730300 1.0 Na Na14 1 0.99999900 0.20923900 0.19716900 1.0 Na Na15 1 0.99999700 0.20826400 0.69734000 1.0 Fe Fe16 1 0.00008900 0.00021400 0.50029000 1.0 Fe Fe17 1 0.49967100 0.50068200 0.74981800 1.0 Fe Fe18 1 0.00020400 0.00022200 0.00015600 1.0 Fe Fe19 1 0.49993500 0.50000200 0.24984900 1.0 O O20 1 0.49979500 0.00015000 0.00034200 1.0 O O21 1 0.49991300 0.00011300 0.50030000 1.0 O O22 1 0.00008300 0.49997400 0.24978600 1.0 O O23 1 0.00030000 0.50020100 0.74980100 1.0 O O24 1 0.99999400 0.23830300 0.03299300 1.0 O O25 1 0.99999800 0.23846800 0.53327400 1.0 O O26 1 0.50000400 0.73811500 0.28315600 1.0 O O27 1 0.50001300 0.73898300 0.78385800 1.0 O O28 1 0.50001300 0.43309800 0.86944500 1.0 O O29 1 0.50000500 0.43343600 0.36923700 1.0 O O30 1 0.99999300 0.93340800 0.11920600 1.0 O O31 1 0.99999500 0.93311400 0.61950400 1.0 O O32 1 0.50000600 0.56627600 0.13054600 1.0 O O33 1 0.50001100 0.56661800 0.63011600 1.0 O O34 1 0.99999600 0.06608400 0.38087400 1.0 O O35 1 0.99999400 0.06605400 0.88074500 1.0 O O36 1 0.99999400 0.76223500 0.96671800 1.0 O O37 1 0.99999500 0.76220000 0.46667000 1.0 O O38 1 0.50000500 0.26172100 0.21672500 1.0 O O39 1 0.50001300 0.26117400 0.71706200 1.0