# generated using pymatgen data_NaYbAsO4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.19333537 _cell_length_b 6.52621585 _cell_length_c 11.32159897 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural NaYbAsO4 _chemical_formula_sum 'Na4 Yb4 As4 O16' _cell_volume 383.72100200 _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 0.00000000 0.00000000 0.50000000 1.0 Na Na1 1 0.50000000 0.50000000 0.00000000 1.0 Na Na2 1 0.00000000 0.50000000 0.50000000 1.0 Na Na3 1 0.50000000 0.00000000 0.00000000 1.0 Yb Yb4 1 0.50188942 0.75000000 0.27939452 1.0 Yb Yb5 1 0.99811058 0.75000000 0.77939452 1.0 Yb Yb6 1 0.49811058 0.25000000 0.72060548 1.0 Yb Yb7 1 0.00188942 0.25000000 0.22060548 1.0 As As8 1 0.43366861 0.75000000 0.59937988 1.0 As As9 1 0.06633139 0.75000000 0.09937988 1.0 As As10 1 0.56633139 0.25000000 0.40062012 1.0 As As11 1 0.93366861 0.25000000 0.90062012 1.0 O O12 1 0.31780220 0.75000000 0.45931335 1.0 O O13 1 0.18219780 0.75000000 0.95931335 1.0 O O14 1 0.68219780 0.25000000 0.54068665 1.0 O O15 1 0.81780220 0.25000000 0.04068665 1.0 O O16 1 0.75798687 0.75000000 0.60599643 1.0 O O17 1 0.74201313 0.75000000 0.10599643 1.0 O O18 1 0.24201313 0.25000000 0.39400357 1.0 O O19 1 0.25798687 0.25000000 0.89400357 1.0 O O20 1 0.29406057 0.54690561 0.67062087 1.0 O O21 1 0.20593943 0.95309439 0.17062087 1.0 O O22 1 0.70593943 0.04690561 0.32937913 1.0 O O23 1 0.79406057 0.45309439 0.82937913 1.0 O O24 1 0.70593943 0.45309439 0.32937913 1.0 O O25 1 0.79406057 0.04690561 0.82937913 1.0 O O26 1 0.29406057 0.95309439 0.67062087 1.0 O O27 1 0.20593943 0.54690561 0.17062087 1.0