# generated using pymatgen data_Pr3AlAu5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.67274305 _cell_length_b 8.67274335 _cell_length_c 13.83028857 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 128.51876794 _symmetry_Int_Tables_number 1 _chemical_formula_structural Pr3AlAu5 _chemical_formula_sum 'Pr12 Al4 Au20' _cell_volume 813.90813762 _cell_formula_units_Z 4 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 0.93086488 0.06913512 0.25000000 1.0 Pr Pr1 1 0.06913512 0.93086488 0.75000000 1.0 Pr Pr2 1 0.31823535 0.68176465 0.25000000 1.0 Pr Pr3 1 0.68176465 0.31823535 0.75000000 1.0 Pr Pr4 1 0.63247984 0.36752016 0.46582664 1.0 Pr Pr5 1 0.36752016 0.63247984 0.53417336 1.0 Pr Pr6 1 0.63247984 0.36752016 0.03417336 1.0 Pr Pr7 1 0.36752016 0.63247984 0.96582664 1.0 Pr Pr8 1 0.88386192 0.11613808 0.95005251 1.0 Pr Pr9 1 0.11613808 0.88386192 0.04994749 1.0 Pr Pr10 1 0.88386192 0.11613808 0.54994749 1.0 Pr Pr11 1 0.11613808 0.88386192 0.45005251 1.0 Al Al12 1 0.72004026 0.27995974 0.25000000 1.0 Al Al13 1 0.27995974 0.72004026 0.75000000 1.0 Al Al14 1 0.53368881 0.46631119 0.25000000 1.0 Al Al15 1 0.46631119 0.53368881 0.75000000 1.0 Au Au16 1 0.32796102 0.07234940 0.25000000 1.0 Au Au17 1 0.07234940 0.32796102 0.75000000 1.0 Au Au18 1 0.67203898 0.92765060 0.75000000 1.0 Au Au19 1 0.92765060 0.67203898 0.25000000 1.0 Au Au20 1 0.57924432 0.00817698 0.39446596 1.0 Au Au21 1 0.00817698 0.57924432 0.60553404 1.0 Au Au22 1 0.57924432 0.00817698 0.10553404 1.0 Au Au23 1 0.00817698 0.57924432 0.89446596 1.0 Au Au24 1 0.42075568 0.99182302 0.60553404 1.0 Au Au25 1 0.99182302 0.42075568 0.39446596 1.0 Au Au26 1 0.42075568 0.99182302 0.89446596 1.0 Au Au27 1 0.99182302 0.42075568 0.10553404 1.0 Au Au28 1 0.67999800 0.73449798 0.39281938 1.0 Au Au29 1 0.73449798 0.67999800 0.60718062 1.0 Au Au30 1 0.67999800 0.73449798 0.10718062 1.0 Au Au31 1 0.73449798 0.67999800 0.89281938 1.0 Au Au32 1 0.32000200 0.26550202 0.60718062 1.0 Au Au33 1 0.26550202 0.32000200 0.39281938 1.0 Au Au34 1 0.32000200 0.26550202 0.89281938 1.0 Au Au35 1 0.26550202 0.32000200 0.10718062 1.0