# generated using pymatgen data_Ba3Yb4O9 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.99476008 _cell_length_b 8.99476008 _cell_length_c 8.99476035 _cell_angle_alpha 38.98317928 _cell_angle_beta 38.98317928 _cell_angle_gamma 38.98317879 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ba3Yb4O9 _chemical_formula_sum 'Ba3 Yb4 O9' _cell_volume 258.99764206 _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 Ba Ba0 1 0.01162409 0.01162409 0.01162409 1.0 Ba Ba1 1 0.17429318 0.17429318 0.17429318 1.0 Ba Ba2 1 0.59089706 0.59089706 0.59089706 1.0 Yb Yb3 1 0.43575765 0.43575765 0.43575765 1.0 Yb Yb4 1 0.87510332 0.87510332 0.87510332 1.0 Yb Yb5 1 0.75037711 0.75037711 0.75037711 1.0 Yb Yb6 1 0.31131790 0.31131790 0.31131790 1.0 O O7 1 0.57279086 0.48868618 0.05028038 1.0 O O8 1 0.05028038 0.57279086 0.48868618 1.0 O O9 1 0.48868618 0.05028038 0.57279086 1.0 O O10 1 0.68367581 0.62756753 0.13806856 1.0 O O11 1 0.13806856 0.68367581 0.62756753 1.0 O O12 1 0.62756753 0.13806856 0.68367581 1.0 O O13 1 0.59208132 0.05301071 0.13396634 1.0 O O14 1 0.05301071 0.13396634 0.59208132 1.0 O O15 1 0.13396634 0.59208132 0.05301071 1.0