# generated using pymatgen data_Ba2Na(CuO2)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.30711551 _cell_length_b 8.45823439 _cell_length_c 7.15746373 _cell_angle_alpha 72.62922948 _cell_angle_beta 60.15153183 _cell_angle_gamma 47.21923869 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ba2Na(CuO2)3 _chemical_formula_sum 'Ba4 Na2 Cu6 O12' _cell_volume 357.99736716 _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 Ba Ba0 1 0.25000000 0.25000000 0.25000000 1.0 Ba Ba1 1 0.75000000 0.75000000 0.75000000 1.0 Ba Ba2 1 0.76875400 0.23124600 0.76875400 1.0 Ba Ba3 1 0.23124600 0.76875400 0.23124600 1.0 Na Na4 1 0.33054900 0.33054900 0.66945100 1.0 Na Na5 1 0.66945100 0.66945100 0.33054900 1.0 Cu Cu6 1 0.30002200 0.99682700 0.69997800 1.0 Cu Cu7 1 0.00317300 0.69997800 0.99682700 1.0 Cu Cu8 1 0.99682700 0.30002200 0.00317300 1.0 Cu Cu9 1 0.69997800 0.00317300 0.30002200 1.0 Cu Cu10 1 0.69012900 0.30987100 0.30987100 1.0 Cu Cu11 1 0.30987100 0.69012900 0.69012900 1.0 O O12 1 0.68355200 0.50183400 0.09234500 1.0 O O13 1 0.72226900 0.09234500 0.50183400 1.0 O O14 1 0.09234500 0.72226900 0.68355200 1.0 O O15 1 0.50183400 0.68355200 0.72226900 1.0 O O16 1 0.31644800 0.49816600 0.90765500 1.0 O O17 1 0.27773100 0.90765500 0.49816600 1.0 O O18 1 0.30515700 0.07160200 0.92839800 1.0 O O19 1 0.49816600 0.31644800 0.27773100 1.0 O O20 1 0.07160200 0.30515700 0.69484300 1.0 O O21 1 0.92839800 0.69484300 0.30515700 1.0 O O22 1 0.69484300 0.92839800 0.07160200 1.0 O O23 1 0.90765500 0.27773100 0.31644800 1.0