# generated using pymatgen data_Na2CoO3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.34032146 _cell_length_b 5.34032146 _cell_length_c 10.93157643 _cell_angle_alpha 84.89505186 _cell_angle_beta 84.89505186 _cell_angle_gamma 120.38901346 _symmetry_Int_Tables_number 1 _chemical_formula_structural Na2CoO3 _chemical_formula_sum 'Na8 Co4 O12' _cell_volume 264.58167808 _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 0.84179400 0.68380900 0.99966300 1.0 Na Na1 1 0.00000000 0.50000000 0.50000000 1.0 Na Na2 1 0.91403500 0.08596500 0.75000000 1.0 Na Na3 1 0.50000000 0.00000000 0.00000000 1.0 Na Na4 1 0.31619100 0.15820600 0.50033700 1.0 Na Na5 1 0.68380900 0.84179400 0.49966300 1.0 Na Na6 1 0.08596500 0.91403500 0.25000000 1.0 Na Na7 1 0.15820600 0.31619100 0.00033700 1.0 Co Co8 1 0.74751400 0.25248600 0.25000000 1.0 Co Co9 1 0.58372600 0.41627400 0.75000000 1.0 Co Co10 1 0.41627400 0.58372600 0.25000000 1.0 Co Co11 1 0.25248600 0.74751400 0.75000000 1.0 O O12 1 0.94201300 0.73715800 0.64921900 1.0 O O13 1 0.67582400 0.48849800 0.34908900 1.0 O O14 1 0.87947100 0.43709000 0.85047500 1.0 O O15 1 0.51150200 0.32417600 0.15091100 1.0 O O16 1 0.73715800 0.94201300 0.14921900 1.0 O O17 1 0.43709000 0.87947100 0.35047500 1.0 O O18 1 0.56291000 0.12052900 0.64952500 1.0 O O19 1 0.26284200 0.05798700 0.85078100 1.0 O O20 1 0.48849800 0.67582400 0.84908900 1.0 O O21 1 0.12052900 0.56291000 0.14952500 1.0 O O22 1 0.32417600 0.51150200 0.65091100 1.0 O O23 1 0.05798700 0.26284200 0.35078100 1.0