# generated using pymatgen data_NaCu3O4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.06596504 _cell_length_b 6.06596504 _cell_length_c 3.51214653 _cell_angle_alpha 89.93854016 _cell_angle_beta 89.93854016 _cell_angle_gamma 53.45100182 _symmetry_Int_Tables_number 1 _chemical_formula_structural NaCu3O4 _chemical_formula_sum 'Na1 Cu3 O4' _cell_volume 103.81874526 _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 0.99322600 0.99322600 0.50468300 1.0 Cu Cu1 1 0.23882800 0.23882800 0.00121700 1.0 Cu Cu2 1 0.75498500 0.75498500 0.00869600 1.0 Cu Cu3 1 0.49743300 0.49743300 0.99114300 1.0 O O4 1 0.87002800 0.38476200 0.00834700 1.0 O O5 1 0.38476200 0.87002800 0.00834700 1.0 O O6 1 0.60836400 0.12467800 0.99740500 1.0 O O7 1 0.12467800 0.60836400 0.99740500 1.0