# generated using pymatgen data_NaNi3O8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.80890315 _cell_length_b 4.80890315 _cell_length_c 7.05559338 _cell_angle_alpha 83.50003092 _cell_angle_beta 83.50003092 _cell_angle_gamma 119.99055033 _symmetry_Int_Tables_number 1 _chemical_formula_structural NaNi3O8 _chemical_formula_sum 'Na1 Ni3 O8' _cell_volume 137.64951339 _cell_formula_units_Z 1 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 0.99999700 0.99999700 0.49967000 1.0 Ni Ni1 1 0.81893100 0.81893100 0.00219500 1.0 Ni Ni2 1 0.48711800 0.15353700 0.99911300 1.0 Ni Ni3 1 0.15353700 0.48711800 0.99911300 1.0 O O4 1 0.19764500 0.19764500 0.85988100 1.0 O O5 1 0.43614900 0.43614900 0.14107200 1.0 O O6 1 0.86683200 0.53538800 0.85930700 1.0 O O7 1 0.53538800 0.86683200 0.85930700 1.0 O O8 1 0.10817200 0.77507300 0.14090500 1.0 O O9 1 0.77507300 0.10817200 0.14090500 1.0 O O10 1 0.66812600 0.33303300 0.49926700 1.0 O O11 1 0.33303300 0.66812600 0.49926700 1.0