# generated using pymatgen data_PrPa(Al5Fe)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.72309088 _cell_length_b 6.72309104 _cell_length_c 8.92235073 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 97.86491040 _symmetry_Int_Tables_number 1 _chemical_formula_structural PrPa(Al5Fe)4 _chemical_formula_sum 'Pr1 Pa1 Al20 Fe4' _cell_volume 399.49625996 _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 0.12490230 0.87509770 0.25000000 1.0 Pa Pa1 1 0.87419291 0.12580709 0.75000000 1.0 Al Al2 1 0.62376864 0.37623136 0.55315400 1.0 Al Al3 1 0.37492727 0.62507273 0.45375573 1.0 Al Al4 1 0.37492727 0.62507273 0.04624427 1.0 Al Al5 1 0.62376864 0.37623136 0.94684600 1.0 Al Al6 1 0.22781752 0.22704813 0.50153276 1.0 Al Al7 1 0.77295187 0.77218248 0.50153276 1.0 Al Al8 1 0.77295187 0.77218248 0.99846724 1.0 Al Al9 1 0.22781752 0.22704813 0.99846724 1.0 Al Al10 1 0.83776591 0.16223409 0.09803596 1.0 Al Al11 1 0.15791571 0.84208429 0.90062484 1.0 Al Al12 1 0.15791571 0.84208429 0.59937516 1.0 Al Al13 1 0.83776591 0.16223409 0.40196404 1.0 Al Al14 1 0.86753070 0.59149408 0.75000000 1.0 Al Al15 1 0.13414456 0.40901413 0.25000000 1.0 Al Al16 1 0.40850592 0.13246930 0.75000000 1.0 Al Al17 1 0.59098587 0.86585544 0.25000000 1.0 Al Al18 1 0.22006455 0.47941213 0.75000000 1.0 Al Al19 1 0.77886382 0.51928922 0.25000000 1.0 Al Al20 1 0.52058787 0.77993545 0.75000000 1.0 Al Al21 1 0.48071078 0.22113618 0.25000000 1.0 Fe Fe22 1 0.99865758 0.49404965 0.50442436 1.0 Fe Fe23 1 0.99865758 0.49404965 0.99557564 1.0 Fe Fe24 1 0.50595035 0.00134242 0.99557564 1.0 Fe Fe25 1 0.50595035 0.00134242 0.50442436 1.0