# generated using pymatgen data_Pr20IrRu3Pt8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 11.40377946 _cell_length_b 11.40377946 _cell_length_c 6.64337261 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Pr20IrRu3Pt8 _chemical_formula_sum 'Pr20 Ir1 Ru3 Pt8' _cell_volume 863.94526983 _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 Pr Pr0 1 0.29787116 0.08846669 0.37510393 1.0 Pr Pr1 1 0.29800468 0.91179529 0.87524393 1.0 Pr Pr2 1 0.70199532 0.08820471 0.87524393 1.0 Pr Pr3 1 0.70212884 0.91153331 0.37510393 1.0 Pr Pr4 1 0.58820471 0.79800468 0.87524393 1.0 Pr Pr5 1 0.58846669 0.20212884 0.37510393 1.0 Pr Pr6 1 0.41153331 0.79787116 0.37510393 1.0 Pr Pr7 1 0.41179529 0.20199532 0.87524393 1.0 Pr Pr8 1 0.20343900 0.40994107 0.62610872 1.0 Pr Pr9 1 0.20314067 0.58994340 0.12388586 1.0 Pr Pr10 1 0.79685933 0.41005660 0.12388586 1.0 Pr Pr11 1 0.79656100 0.59005893 0.62610872 1.0 Pr Pr12 1 0.91005660 0.70314067 0.12388586 1.0 Pr Pr13 1 0.90994107 0.29656100 0.62610872 1.0 Pr Pr14 1 0.09005893 0.70343900 0.62610872 1.0 Pr Pr15 1 0.08994340 0.29685933 0.12388586 1.0 Pr Pr16 1 0.00000000 0.00000000 0.49884023 1.0 Pr Pr17 1 0.00000000 0.00000000 0.99865305 1.0 Pr Pr18 1 0.50000000 0.50000000 0.99865305 1.0 Pr Pr19 1 0.50000000 0.50000000 0.49884023 1.0 Ir Ir20 1 0.00000000 0.50000000 0.38615467 1.0 Ru Ru21 1 0.50000000 0.00000000 0.11717421 1.0 Ru Ru22 1 0.50000000 0.00000000 0.61711507 1.0 Ru Ru23 1 0.00000000 0.50000000 0.88721172 1.0 Pt Pt24 1 0.84704456 0.15317332 0.24958048 1.0 Pt Pt25 1 0.84666804 0.84668992 0.74941751 1.0 Pt Pt26 1 0.15333196 0.15331008 0.74941751 1.0 Pt Pt27 1 0.15295544 0.84682668 0.24958048 1.0 Pt Pt28 1 0.65331008 0.34666804 0.74941751 1.0 Pt Pt29 1 0.65317332 0.65295544 0.24958048 1.0 Pt Pt30 1 0.34682668 0.34704456 0.24958048 1.0 Pt Pt31 1 0.34668992 0.65333196 0.74941751 1.0