# generated using pymatgen data_Na5Fe3F14 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.42880800 _cell_length_b 7.52872700 _cell_length_c 12.87864626 _cell_angle_alpha 55.22259577 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Na5Fe3F14 _chemical_formula_sum 'Na10 Fe6 F28' _cell_volume 591.63242055 _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 Na Na0 1 0.69845200 0.99438900 0.24748000 1.0 Na Na1 1 0.80154800 0.99438900 0.74748000 1.0 Na Na2 1 0.30154800 0.00561100 0.75252000 1.0 Na Na3 1 0.25429200 0.51077500 0.26165200 1.0 Na Na4 1 0.75429200 0.48922500 0.23834800 1.0 Na Na5 1 0.24570800 0.51077500 0.76165200 1.0 Na Na6 1 0.00000000 0.50000000 0.50000000 1.0 Na Na7 1 0.50000000 0.50000000 0.00000000 1.0 Na Na8 1 0.74570800 0.48922500 0.73834800 1.0 Na Na9 1 0.19845200 0.00561100 0.25252000 1.0 Fe Fe10 1 0.00000000 0.00000000 0.50000000 1.0 Fe Fe11 1 0.50000000 0.00000000 0.50000000 1.0 Fe Fe12 1 0.50000000 0.00000000 0.00000000 1.0 Fe Fe13 1 0.00000000 0.50000000 0.00000000 1.0 Fe Fe14 1 0.00000000 0.00000000 0.00000000 1.0 Fe Fe15 1 0.50000000 0.50000000 0.50000000 1.0 F F16 1 0.29130900 0.64412500 0.39095000 1.0 F F17 1 0.57345500 0.74942100 0.50275900 1.0 F F18 1 0.33752400 0.38613500 0.64283200 1.0 F F19 1 0.05958300 0.81249000 0.17592700 1.0 F F20 1 0.20869100 0.64412500 0.89095000 1.0 F F21 1 0.43604800 0.04875700 0.12827400 1.0 F F22 1 0.83752400 0.61386500 0.85716800 1.0 F F23 1 0.06395200 0.04875700 0.62827400 1.0 F F24 1 0.79130900 0.35587500 0.10905000 1.0 F F25 1 0.24728300 0.99335000 0.94624700 1.0 F F26 1 0.93604700 0.95124300 0.37172600 1.0 F F27 1 0.66247600 0.61386500 0.35716800 1.0 F F28 1 0.99417900 0.31534500 0.38161700 1.0 F F29 1 0.00582100 0.68465500 0.61838300 1.0 F F30 1 0.07345500 0.25057900 0.99724100 1.0 F F31 1 0.50582100 0.31534500 0.88161700 1.0 F F32 1 0.55958300 0.18751000 0.32407300 1.0 F F33 1 0.70869100 0.35587500 0.60905000 1.0 F F34 1 0.44041700 0.81249000 0.67592700 1.0 F F35 1 0.42654500 0.25057900 0.49724100 1.0 F F36 1 0.75271700 0.00665000 0.05375300 1.0 F F37 1 0.25271700 0.99335000 0.44624700 1.0 F F38 1 0.49417900 0.68465500 0.11838300 1.0 F F39 1 0.94041700 0.18751000 0.82407300 1.0 F F40 1 0.92654500 0.74942100 0.00275900 1.0 F F41 1 0.16247600 0.38613500 0.14283200 1.0 F F42 1 0.56395200 0.95124300 0.87172600 1.0 F F43 1 0.74728300 0.00665000 0.55375300 1.0