# generated using pymatgen data_Pr6Sc4Al12Ir7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.20443561 _cell_length_b 9.20443700 _cell_length_c 9.20443656 _cell_angle_alpha 59.99999802 _cell_angle_beta 59.99999301 _cell_angle_gamma 60.00000652 _symmetry_Int_Tables_number 1 _chemical_formula_structural Pr6Sc4Al12Ir7 _chemical_formula_sum 'Pr6 Sc4 Al12 Ir7' _cell_volume 551.41248719 _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 0.70534735 0.70534735 0.29465265 1.0 Pr Pr1 1 0.29465265 0.70534735 0.29465265 1.0 Pr Pr2 1 0.70534735 0.29465265 0.29465265 1.0 Pr Pr3 1 0.29465265 0.29465265 0.70534735 1.0 Pr Pr4 1 0.70534735 0.29465265 0.70534735 1.0 Pr Pr5 1 0.29465265 0.70534735 0.70534735 1.0 Sc Sc6 1 0.88170673 0.88170673 0.35488080 1.0 Sc Sc7 1 0.88170673 0.35488080 0.88170673 1.0 Sc Sc8 1 0.35488080 0.88170673 0.88170673 1.0 Sc Sc9 1 0.88170673 0.88170673 0.88170673 1.0 Al Al10 1 0.12080788 0.12080788 0.63757535 1.0 Al Al11 1 0.12080788 0.63757535 0.12080788 1.0 Al Al12 1 0.63757535 0.12080788 0.12080788 1.0 Al Al13 1 0.12080788 0.12080788 0.12080788 1.0 Al Al14 1 0.67220167 0.67220167 0.98339599 1.0 Al Al15 1 0.67220167 0.98339599 0.67220167 1.0 Al Al16 1 0.98339599 0.67220167 0.67220167 1.0 Al Al17 1 0.67220167 0.67220167 0.67220167 1.0 Al Al18 1 0.32569091 0.32569091 0.02292628 1.0 Al Al19 1 0.32569091 0.02292628 0.32569091 1.0 Al Al20 1 0.02292628 0.32569091 0.32569091 1.0 Al Al21 1 0.32569091 0.32569091 0.32569091 1.0 Ir Ir22 1 0.00000000 0.00000000 0.00000000 1.0 Ir Ir23 1 0.00182838 0.00182838 0.49817162 1.0 Ir Ir24 1 0.49817162 0.00182838 0.49817162 1.0 Ir Ir25 1 0.00182838 0.49817162 0.49817162 1.0 Ir Ir26 1 0.49817162 0.49817162 0.00182838 1.0 Ir Ir27 1 0.00182838 0.49817162 0.00182838 1.0 Ir Ir28 1 0.49817162 0.00182838 0.00182838 1.0