# generated using pymatgen data_NaTaO3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.42763000 _cell_length_b 7.43728285 _cell_length_c 12.67246936 _cell_angle_alpha 105.83116924 _cell_angle_beta 90.69964474 _cell_angle_gamma 118.77017246 _symmetry_Int_Tables_number 1 _chemical_formula_structural NaTaO3 _chemical_formula_sum 'Na8 Ta8 O24' _cell_volume 581.74322507 _cell_formula_units_Z 8 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 0.43535400 0.96468700 0.52417000 1.0 Na Na1 1 0.19622300 0.44630000 0.77201800 1.0 Na Na2 1 0.22403800 0.00316300 0.76249000 1.0 Na Na3 1 0.77926700 0.02762300 0.74588100 1.0 Na Na4 1 0.81150100 0.57360500 0.22737900 1.0 Na Na5 1 0.53534000 0.53745400 0.48623700 1.0 Na Na6 1 0.24959900 0.99386900 0.24650000 1.0 Na Na7 1 0.95731800 0.44261800 0.02580800 1.0 Ta Ta8 1 0.99397000 0.99297100 0.00165900 1.0 Ta Ta9 1 0.73655200 0.49555300 0.75246900 1.0 Ta Ta10 1 0.51356100 0.50998600 0.99431000 1.0 Ta Ta11 1 0.93363600 0.45944500 0.51210900 1.0 Ta Ta12 1 0.24182100 0.49138800 0.25352700 1.0 Ta Ta13 1 0.70007700 0.99768100 0.30001600 1.0 Ta Ta14 1 0.51304900 0.00676300 0.99634000 1.0 Ta Ta15 1 0.92370200 0.95439500 0.51502600 1.0 O O16 1 0.86570000 0.14452900 0.96119300 1.0 O O17 1 0.98074300 0.83784500 0.61312100 1.0 O O18 1 0.87544600 0.76854100 0.95676200 1.0 O O19 1 0.96835800 0.20254400 0.54766500 1.0 O O20 1 0.77937500 0.67485100 0.82043900 1.0 O O21 1 0.65524000 0.73738600 0.15390400 1.0 O O22 1 0.83571400 0.39745200 0.65322300 1.0 O O23 1 0.51066900 0.78509700 0.94846900 1.0 O O24 1 0.28693800 0.75559400 0.15182200 1.0 O O25 1 0.35099600 0.74210000 0.44511400 1.0 O O26 1 0.78058200 0.29955900 0.82645900 1.0 O O27 1 0.56707700 0.23571800 0.57190500 1.0 O O28 1 0.81831300 0.82460000 0.29039200 1.0 O O29 1 0.55583100 0.26568100 0.02169100 1.0 O O30 1 0.14618200 0.57487700 0.35455600 1.0 O O31 1 0.55297300 0.75251500 0.58719200 1.0 O O32 1 0.36584100 0.28999000 0.81918400 1.0 O O33 1 0.28618400 0.38335600 0.14881200 1.0 O O34 1 0.96026500 0.75047000 0.46691000 1.0 O O35 1 0.19512500 0.23216500 0.35546900 1.0 O O36 1 0.67629200 0.15315200 0.20562000 1.0 O O37 1 0.20253700 0.27707100 0.00758200 1.0 O O38 1 0.18074200 0.88835100 0.01882900 1.0 O O39 1 0.83887000 0.23505700 0.33274800 1.0