# generated using pymatgen data_Pr4Al18HgIr5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.63815462 _cell_length_b 7.63815335 _cell_length_c 9.61435318 _cell_angle_alpha 89.83381836 _cell_angle_beta 89.83381665 _cell_angle_gamma 119.26179601 _symmetry_Int_Tables_number 1 _chemical_formula_structural Pr4Al18HgIr5 _chemical_formula_sum 'Pr4 Al18 Hg1 Ir5' _cell_volume 489.33142464 _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 0.99613794 0.67737152 0.25001028 1.0 Pr Pr1 1 0.00386206 0.32262848 0.74998972 1.0 Pr Pr2 1 0.67737152 0.99613794 0.25001028 1.0 Pr Pr3 1 0.32262848 0.00386206 0.74998972 1.0 Al Al4 1 0.14489634 0.14489634 0.26397277 1.0 Al Al5 1 0.85510366 0.85510366 0.73602723 1.0 Al Al6 1 0.00707359 0.35221685 0.07782545 1.0 Al Al7 1 0.99292641 0.64778315 0.92217455 1.0 Al Al8 1 0.99842042 0.66277328 0.56871696 1.0 Al Al9 1 0.33722672 0.00157958 0.43128304 1.0 Al Al10 1 0.00157958 0.33722672 0.43128304 1.0 Al Al11 1 0.66277328 0.99842042 0.56871696 1.0 Al Al12 1 0.64778315 0.99292641 0.92217455 1.0 Al Al13 1 0.35221685 0.00707359 0.07782545 1.0 Al Al14 1 0.33447790 0.33447790 0.54340494 1.0 Al Al15 1 0.66552210 0.66552210 0.45659506 1.0 Al Al16 1 0.64874206 0.64874206 0.06020602 1.0 Al Al17 1 0.35125794 0.35125794 0.93979398 1.0 Al Al18 1 0.34000963 0.55023760 0.25304348 1.0 Al Al19 1 0.65999037 0.44976240 0.74695652 1.0 Al Al20 1 0.55023760 0.34000963 0.25304348 1.0 Al Al21 1 0.44976240 0.65999037 0.74695652 1.0 Hg Hg22 1 0.00000000 0.00000000 0.00000000 1.0 Ir Ir23 1 0.67089787 0.32910213 0.00000000 1.0 Ir Ir24 1 0.32910213 0.67089787 1.00000000 1.0 Ir Ir25 1 0.32910056 0.67089944 0.50000000 1.0 Ir Ir26 1 0.67089944 0.32910056 0.50000000 1.0 Ir Ir27 1 0.00000000 0.00000000 0.50000000 1.0