# generated using pymatgen data_Ca5AgAu2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.18768798 _cell_length_b 9.18768740 _cell_length_c 9.18768779 _cell_angle_alpha 128.79390979 _cell_angle_beta 128.79390393 _cell_angle_gamma 75.34241022 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ca5AgAu2 _chemical_formula_sum 'Ca10 Ag2 Au4' _cell_volume 458.54582385 _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 Ca Ca0 1 0.47449653 0.97449653 0.16620817 1.0 Ca Ca1 1 0.19171364 0.69171364 0.16620817 1.0 Ca Ca2 1 0.52550347 0.02550347 0.83379183 1.0 Ca Ca3 1 0.02550347 0.19171364 0.50000000 1.0 Ca Ca4 1 0.69171364 0.52550347 0.50000000 1.0 Ca Ca5 1 0.97449653 0.80828636 0.50000000 1.0 Ca Ca6 1 0.00000000 0.00000000 0.00000000 1.0 Ca Ca7 1 0.50000000 0.50000000 0.00000000 1.0 Ca Ca8 1 0.80828636 0.30828636 0.83379183 1.0 Ca Ca9 1 0.30828636 0.47449653 0.50000000 1.0 Ag Ag10 1 0.75000000 0.75000000 0.00000000 1.0 Ag Ag11 1 0.25000000 0.25000000 0.00000000 1.0 Au Au12 1 0.13015022 0.63015022 0.76029844 1.0 Au Au13 1 0.63015022 0.86984978 0.50000000 1.0 Au Au14 1 0.36984978 0.13015022 0.50000000 1.0 Au Au15 1 0.86984978 0.36984978 0.23970156 1.0