# generated using pymatgen data_Na3Bi(P2O7)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.40719600 _cell_length_b 9.65342044 _cell_length_c 9.71354802 _cell_angle_alpha 80.67687532 _cell_angle_beta 77.32513795 _cell_angle_gamma 69.81272828 _symmetry_Int_Tables_number 1 _chemical_formula_structural Na3Bi(P2O7)2 _chemical_formula_sum 'Na6 Bi2 P8 O28' _cell_volume 633.18183015 _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 0.35480800 0.14859700 0.27365400 1.0 Na Na1 1 0.05244500 0.50077500 0.16174000 1.0 Na Na2 1 0.44253400 0.45859900 0.33184400 1.0 Na Na3 1 0.55746600 0.54140100 0.66815600 1.0 Na Na4 1 0.94755500 0.49922500 0.83826000 1.0 Na Na5 1 0.64519200 0.85140300 0.72634600 1.0 Bi Bi6 1 0.88049800 0.12228900 0.78149300 1.0 Bi Bi7 1 0.11950200 0.87771100 0.21850700 1.0 P P8 1 0.18494400 0.13541900 0.97454300 1.0 P P9 1 0.72862200 0.10770600 0.45107900 1.0 P P10 1 0.41375300 0.33375700 0.94470100 1.0 P P11 1 0.90209900 0.34153200 0.45273200 1.0 P P12 1 0.09790100 0.65846800 0.54726800 1.0 P P13 1 0.58624700 0.66624300 0.05529900 1.0 P P14 1 0.27137800 0.89229400 0.54892100 1.0 P P15 1 0.81505600 0.86458100 0.02545700 1.0 O O16 1 0.17896500 0.03494500 0.62393000 1.0 O O17 1 0.12234800 0.16301200 0.13073200 1.0 O O18 1 0.76856700 0.02847100 0.04386200 1.0 O O19 1 0.69150100 0.07786900 0.61431300 1.0 O O20 1 0.03650500 0.23659200 0.87881100 1.0 O O21 1 0.54446100 0.20865900 0.39712500 1.0 O O22 1 0.38316000 0.18115400 0.91522000 1.0 O O23 1 0.09477300 0.35653800 0.37337900 1.0 O O24 1 0.41022600 0.33422800 0.10263800 1.0 O O25 1 0.89620200 0.18656900 0.41132600 1.0 O O26 1 0.60818300 0.32988900 0.84733800 1.0 O O27 1 0.88252800 0.32474700 0.61647600 1.0 O O28 1 0.24187900 0.46737100 0.90443700 1.0 O O29 1 0.27797200 0.53260600 0.58560600 1.0 O O30 1 0.72202800 0.46739400 0.41439400 1.0 O O31 1 0.75812100 0.53262900 0.09556300 1.0 O O32 1 0.11747200 0.67525300 0.38352400 1.0 O O33 1 0.39181700 0.67011100 0.15266200 1.0 O O34 1 0.10379800 0.81343100 0.58867400 1.0 O O35 1 0.58977400 0.66577200 0.89736200 1.0 O O36 1 0.90522700 0.64346200 0.62662100 1.0 O O37 1 0.61684000 0.81884600 0.08478000 1.0 O O38 1 0.45553900 0.79134100 0.60287500 1.0 O O39 1 0.96349500 0.76340800 0.12118900 1.0 O O40 1 0.30849900 0.92213100 0.38568700 1.0 O O41 1 0.23143300 0.97152900 0.95613800 1.0 O O42 1 0.87765200 0.83698800 0.86926800 1.0 O O43 1 0.82103500 0.96505500 0.37607000 1.0