# generated using pymatgen data_Pr3Al12(RuRh)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.90324423 _cell_length_b 8.86185743 _cell_length_c 9.62631705 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.84634399 _symmetry_Int_Tables_number 1 _chemical_formula_structural Pr3Al12(RuRh)2 _chemical_formula_sum 'Pr6 Al24 Ru4 Rh4' _cell_volume 658.77057723 _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 Pr Pr0 1 0.18863655 0.38317710 0.25000000 1.0 Pr Pr1 1 0.81136345 0.61682290 0.75000000 1.0 Pr Pr2 1 0.62002478 0.81001289 0.25000000 1.0 Pr Pr3 1 0.37997522 0.18998711 0.75000000 1.0 Pr Pr4 1 0.18863655 0.80545845 0.25000000 1.0 Pr Pr5 1 0.81136345 0.19454155 0.75000000 1.0 Al Al6 1 0.33170178 0.66585139 0.00985056 1.0 Al Al7 1 0.66829822 0.33414861 0.99014944 1.0 Al Al8 1 0.66829822 0.33414861 0.50985056 1.0 Al Al9 1 0.33170178 0.66585139 0.49014944 1.0 Al Al10 1 0.16222279 0.32652219 0.57581284 1.0 Al Al11 1 0.83777721 0.67347781 0.42418716 1.0 Al Al12 1 0.67453222 0.83726511 0.57612401 1.0 Al Al13 1 0.83777721 0.67347781 0.07581284 1.0 Al Al14 1 0.32546778 0.16273489 0.42387599 1.0 Al Al15 1 0.16222279 0.32652219 0.92418716 1.0 Al Al16 1 0.16222279 0.83570060 0.57581284 1.0 Al Al17 1 0.32546778 0.16273489 0.07612401 1.0 Al Al18 1 0.83777721 0.16429940 0.42418716 1.0 Al Al19 1 0.67453222 0.83726511 0.92387599 1.0 Al Al20 1 0.83777721 0.16429940 0.07581284 1.0 Al Al21 1 0.16222279 0.83570060 0.92418716 1.0 Al Al22 1 0.56224127 0.12586656 0.25000000 1.0 Al Al23 1 0.43775873 0.87413344 0.75000000 1.0 Al Al24 1 0.87232080 0.43616140 0.25000000 1.0 Al Al25 1 0.12767920 0.56383860 0.75000000 1.0 Al Al26 1 0.56224127 0.43637471 0.25000000 1.0 Al Al27 1 0.43775873 0.56362529 0.75000000 1.0 Al Al28 1 0.99889618 0.99944809 0.25000000 1.0 Al Al29 1 0.00110382 0.00055191 0.75000000 1.0 Ru Ru30 1 0.00000000 0.50000000 0.00000000 1.0 Ru Ru31 1 0.00000000 0.50000000 0.50000000 1.0 Ru Ru32 1 0.00000000 0.00000000 0.00000000 1.0 Ru Ru33 1 0.00000000 0.00000000 0.50000000 1.0 Rh Rh34 1 0.50000000 0.00000000 0.00000000 1.0 Rh Rh35 1 0.50000000 0.00000000 0.50000000 1.0 Rh Rh36 1 0.50000000 0.50000000 0.00000000 1.0 Rh Rh37 1 0.50000000 0.50000000 0.50000000 1.0