# generated using pymatgen data_Na2CoO3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.94906005 _cell_length_b 9.47182069 _cell_length_c 5.40581294 _cell_angle_alpha 78.76367469 _cell_angle_beta 69.03241028 _cell_angle_gamma 32.20391502 _symmetry_Int_Tables_number 1 _chemical_formula_structural Na2CoO3 _chemical_formula_sum 'Na8 Co4 O12' _cell_volume 247.47618569 _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 0.99270100 0.99270100 0.50729900 1.0 Na Na1 1 0.42096300 0.42096300 0.57903700 1.0 Na Na2 1 0.82903700 0.82903700 0.67096300 1.0 Na Na3 1 0.25729900 0.25729900 0.74270100 1.0 Na Na4 1 0.74270100 0.74270100 0.25729900 1.0 Na Na5 1 0.67096300 0.67096300 0.82903700 1.0 Na Na6 1 0.57903700 0.57903700 0.42096300 1.0 Na Na7 1 0.50729900 0.50729900 0.99270100 1.0 Co Co8 1 0.91243500 0.91243500 0.08756500 1.0 Co Co9 1 0.33756500 0.33756500 0.16243500 1.0 Co Co10 1 0.16243500 0.16243500 0.33756500 1.0 Co Co11 1 0.08756500 0.08756500 0.91243500 1.0 O O12 1 0.65020100 0.15701800 0.89403300 1.0 O O13 1 0.15701800 0.65020100 0.29874800 1.0 O O14 1 0.59979900 0.09298200 0.35596700 1.0 O O15 1 0.09298200 0.59979900 0.95125200 1.0 O O16 1 0.44185300 0.05814700 0.05814700 1.0 O O17 1 0.05814700 0.44185300 0.44185300 1.0 O O18 1 0.95125200 0.35596700 0.09298200 1.0 O O19 1 0.35596700 0.95125200 0.59979900 1.0 O O20 1 0.29874800 0.89403300 0.15701800 1.0 O O21 1 0.89403300 0.29874800 0.65020100 1.0 O O22 1 0.80814700 0.19185300 0.19185300 1.0 O O23 1 0.19185300 0.80814700 0.80814700 1.0