# generated using pymatgen data_CaPr(GaIr)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.29536706 _cell_length_b 4.29536706 _cell_length_c 10.02676336 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural CaPr(GaIr)4 _chemical_formula_sum 'Ca1 Pr1 Ga4 Ir4' _cell_volume 184.99557086 _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 Ca Ca0 1 0.50000000 0.00000000 0.76071517 1.0 Pr Pr1 1 0.00000000 0.50000000 0.23547328 1.0 Ga Ga2 1 0.50000000 0.00000000 0.12421814 1.0 Ga Ga3 1 0.00000000 0.00000000 0.50248525 1.0 Ga Ga4 1 0.50000000 0.50000000 0.50248525 1.0 Ga Ga5 1 0.00000000 0.50000000 0.87391676 1.0 Ir Ir6 1 0.00000000 0.00000000 0.99959227 1.0 Ir Ir7 1 0.50000000 0.50000000 0.99959227 1.0 Ir Ir8 1 0.50000000 0.00000000 0.37259266 1.0 Ir Ir9 1 0.00000000 0.50000000 0.62893194 1.0