# generated using pymatgen data_U5Ta3(P3Ir4)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 12.74405259 _cell_length_b 12.74405289 _cell_length_c 3.98334766 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999922 _symmetry_Int_Tables_number 1 _chemical_formula_structural U5Ta3(P3Ir4)4 _chemical_formula_sum 'U5 Ta3 P12 Ir16' _cell_volume 560.26561339 _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 U U0 1 0.33333300 0.66666700 0.50000000 1.0 U U1 1 0.66666700 0.33333300 0.50000000 1.0 U U2 1 0.00000000 0.81333094 0.00000000 1.0 U U3 1 0.18666906 0.18666906 0.00000000 1.0 U U4 1 0.81333094 0.00000000 0.00000000 1.0 Ta Ta5 1 0.00000000 0.45505981 0.50000000 1.0 Ta Ta6 1 0.54494019 0.54494019 0.50000000 1.0 Ta Ta7 1 0.45505981 0.00000000 0.50000000 1.0 P P8 1 0.00000000 0.64298556 0.50000000 1.0 P P9 1 0.35701444 0.35701444 0.50000000 1.0 P P10 1 0.64298556 0.00000000 0.50000000 1.0 P P11 1 0.51650675 0.68452138 0.00000000 1.0 P P12 1 0.31547862 0.83198537 0.00000000 1.0 P P13 1 0.16801463 0.48349325 0.00000000 1.0 P P14 1 0.48349325 0.16801463 0.00000000 1.0 P P15 1 0.68452138 0.51650675 0.00000000 1.0 P P16 1 0.83198537 0.31547862 0.00000000 1.0 P P17 1 1.00000000 0.17867325 0.50000000 1.0 P P18 1 0.82132675 0.82132675 0.50000000 1.0 P P19 1 0.17867325 0.00000000 0.50000000 1.0 Ir Ir20 1 0.50943371 0.86711415 0.00000000 1.0 Ir Ir21 1 0.13288585 0.64232156 0.00000000 1.0 Ir Ir22 1 0.35767844 0.49056629 0.00000000 1.0 Ir Ir23 1 0.49056629 0.35767844 0.00000000 1.0 Ir Ir24 1 0.86711415 0.50943371 0.00000000 1.0 Ir Ir25 1 0.64232156 0.13288585 0.00000000 1.0 Ir Ir26 1 1.00000000 0.28707179 0.00000000 1.0 Ir Ir27 1 0.71292821 0.71292821 0.00000000 1.0 Ir Ir28 1 0.28707179 0.00000000 0.00000000 1.0 Ir Ir29 1 0.62566057 0.80230537 0.50000000 1.0 Ir Ir30 1 0.19769463 0.82335521 0.50000000 1.0 Ir Ir31 1 0.17664479 0.37433943 0.50000000 1.0 Ir Ir32 1 0.37433943 0.17664479 0.50000000 1.0 Ir Ir33 1 0.80230537 0.62566057 0.50000000 1.0 Ir Ir34 1 0.82335521 0.19769463 0.50000000 1.0 Ir Ir35 1 0.00000000 0.00000000 0.50000000 1.0