# generated using pymatgen data_PbAuO2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.75104452 _cell_length_b 3.75104452 _cell_length_c 12.48695200 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000925 _symmetry_Int_Tables_number 1 _chemical_formula_structural PbAuO2 _chemical_formula_sum 'Pb2 Au2 O4' _cell_volume 152.15683707 _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 Pb Pb0 1 0.00000000 0.00000000 0.00000000 1.0 Pb Pb1 1 0.00000000 0.00000000 0.50000000 1.0 Au Au2 1 0.66666700 0.33333300 0.75000000 1.0 Au Au3 1 0.33333300 0.66666700 0.25000000 1.0 O O4 1 0.66666700 0.33333300 0.58917700 1.0 O O5 1 0.33333300 0.66666700 0.08917700 1.0 O O6 1 0.33333300 0.66666700 0.41082300 1.0 O O7 1 0.66666700 0.33333300 0.91082300 1.0