# generated using pymatgen data_Na4FeO5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.02465700 _cell_length_b 10.00108477 _cell_length_c 5.66006669 _cell_angle_alpha 96.09335328 _cell_angle_beta 96.46287785 _cell_angle_gamma 113.15769450 _symmetry_Int_Tables_number 1 _chemical_formula_structural Na4FeO5 _chemical_formula_sum 'Na16 Fe4 O20' _cell_volume 511.35054918 _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 0.90388300 0.50270100 0.09830400 1.0 Na Na1 1 0.80472400 0.99484100 0.19393400 1.0 Na Na2 1 0.45434800 0.75317900 0.06154300 1.0 Na Na3 1 0.36107700 0.27567500 0.15886100 1.0 Na Na4 1 0.00000000 0.00000000 0.00000000 1.0 Na Na5 1 0.60542900 0.99878500 0.40322900 1.0 Na Na6 1 0.93821800 0.24182900 0.54795500 1.0 Na Na7 1 0.84511600 0.72466400 0.64618100 1.0 Na Na8 1 0.50000000 0.50000000 0.50000000 1.0 Na Na9 1 0.15488400 0.27533600 0.35381900 1.0 Na Na10 1 0.06178200 0.75817100 0.45204500 1.0 Na Na11 1 0.39457100 0.00121500 0.59677100 1.0 Na Na12 1 0.63892300 0.72432500 0.84113900 1.0 Na Na13 1 0.54565200 0.24682100 0.93845700 1.0 Na Na14 1 0.19527600 0.00515900 0.80606600 1.0 Na Na15 1 0.09611700 0.49729900 0.90169600 1.0 Fe Fe16 1 0.73448400 0.48804900 0.29232900 1.0 Fe Fe17 1 0.23751400 0.78859200 0.21835600 1.0 Fe Fe18 1 0.76248600 0.21140800 0.78164400 1.0 Fe Fe19 1 0.26551600 0.51195100 0.70767100 1.0 O O20 1 0.68397300 0.60153400 0.11798500 1.0 O O21 1 0.22559700 0.88399600 0.04889200 1.0 O O22 1 0.90448200 0.38326400 0.31735700 1.0 O O23 1 0.60318500 0.20759000 0.19035200 1.0 O O24 1 0.80803000 0.79622800 0.39528400 1.0 O O25 1 0.41252100 0.67709900 0.27624900 1.0 O O26 1 0.15226800 0.47085800 0.15210100 1.0 O O27 1 0.06928900 0.87296900 0.22768700 1.0 O O28 1 0.71031400 0.40611700 0.45240600 1.0 O O29 1 0.34827300 0.06102300 0.34991500 1.0 O O30 1 0.65172700 0.93897700 0.65008500 1.0 O O31 1 0.28968600 0.59388300 0.54759400 1.0 O O32 1 0.93071100 0.12703100 0.77231300 1.0 O O33 1 0.84773200 0.52914200 0.84789900 1.0 O O34 1 0.58747900 0.32290100 0.72375100 1.0 O O35 1 0.19197000 0.20377200 0.60471600 1.0 O O36 1 0.39681500 0.79241000 0.80964800 1.0 O O37 1 0.09551800 0.61673600 0.68264300 1.0 O O38 1 0.77440300 0.11600400 0.95110800 1.0 O O39 1 0.31602700 0.39846600 0.88201500 1.0