# generated using pymatgen data_NaYbVO4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.42132668 _cell_length_b 5.42132666 _cell_length_c 7.04054331 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 115.38765394 _symmetry_Int_Tables_number 1 _chemical_formula_structural NaYbVO4 _chemical_formula_sum 'Na2 Yb2 V2 O8' _cell_volume 186.94365551 _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 Na Na0 1 0.18143890 0.81856110 0.75000000 1.0 Na Na1 1 0.81856110 0.18143890 0.25000000 1.0 Yb Yb2 1 0.50000000 0.50000000 0.50000000 1.0 Yb Yb3 1 0.50000000 0.50000000 0.00000000 1.0 V V4 1 0.85265683 0.14734317 0.75000000 1.0 V V5 1 0.14734317 0.85265683 0.25000000 1.0 O O6 1 0.25582762 0.74417238 0.05525744 1.0 O O7 1 0.74417238 0.25582762 0.55525744 1.0 O O8 1 0.74417238 0.25582762 0.94474256 1.0 O O9 1 0.25582762 0.74417238 0.44474256 1.0 O O10 1 0.20872048 0.27944614 0.75000000 1.0 O O11 1 0.79127952 0.72055386 0.25000000 1.0 O O12 1 0.72055386 0.79127952 0.75000000 1.0 O O13 1 0.27944614 0.20872048 0.25000000 1.0