# generated using pymatgen data_Yb2ZrO4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.59401860 _cell_length_b 9.61804019 _cell_length_c 3.25680725 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Yb2ZrO4 _chemical_formula_sum 'Yb4 Zr2 O8' _cell_volume 175.22761472 _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 Yb Yb0 1 0.56766810 0.18106837 0.50000100 1.0 Yb Yb1 1 0.06766710 0.31893163 0.50000100 1.0 Yb Yb2 1 0.93233290 0.68106937 0.50000100 1.0 Yb Yb3 1 0.43233190 0.81893063 0.50000100 1.0 Zr Zr4 1 0.00000000 0.00000000 0.00000000 1.0 Zr Zr5 1 0.50000100 0.50000000 0.00000000 1.0 O O6 1 0.85916619 0.19827573 0.00000000 1.0 O O7 1 0.35916519 0.30172427 0.00000000 1.0 O O8 1 0.64083481 0.69827673 0.00000000 1.0 O O9 1 0.14083381 0.80172427 0.00000000 1.0 O O10 1 0.23538009 0.04395609 0.50000100 1.0 O O11 1 0.73538009 0.45604491 0.50000100 1.0 O O12 1 0.26462091 0.54395609 0.50000100 1.0 O O13 1 0.76461991 0.95604391 0.50000100 1.0