# generated using pymatgen data_Ca2Ag4Pd3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.38109823 _cell_length_b 5.38109819 _cell_length_c 13.70762012 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.69734044 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ca2Ag4Pd3 _chemical_formula_sum 'Ca4 Ag8 Pd6' _cell_volume 344.78707463 _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 0.32506791 0.32506791 0.12657262 1.0 Ca Ca1 1 0.67493209 0.67493209 0.62657262 1.0 Ca Ca2 1 0.32506791 0.32506791 0.37342738 1.0 Ca Ca3 1 0.67493209 0.67493209 0.87342738 1.0 Ag Ag4 1 0.99477963 0.66419490 0.07813571 1.0 Ag Ag5 1 0.00522037 0.33580510 0.57813571 1.0 Ag Ag6 1 0.66419490 0.99477963 0.42186429 1.0 Ag Ag7 1 0.33580510 0.00522037 0.92186429 1.0 Ag Ag8 1 0.00522037 0.33580510 0.92186429 1.0 Ag Ag9 1 0.99477963 0.66419490 0.42186429 1.0 Ag Ag10 1 0.33580510 0.00522037 0.57813571 1.0 Ag Ag11 1 0.66419490 0.99477963 0.07813571 1.0 Pd Pd12 1 0.82776494 0.82776494 0.25000000 1.0 Pd Pd13 1 0.17223506 0.17223506 0.75000000 1.0 Pd Pd14 1 0.82626550 0.32833178 0.25000000 1.0 Pd Pd15 1 0.17373450 0.67166822 0.75000000 1.0 Pd Pd16 1 0.32833178 0.82626550 0.25000000 1.0 Pd Pd17 1 0.67166822 0.17373450 0.75000000 1.0