# generated using pymatgen data_Pr2Y2P7Ir8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.94700285 _cell_length_b 12.72874574 _cell_length_c 13.13950564 _cell_angle_alpha 81.02261998 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Pr2Y2P7Ir8 _chemical_formula_sum 'Pr4 Y4 P14 Ir16' _cell_volume 652.04733722 _cell_formula_units_Z 2 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 0.25000000 0.10663665 0.78841551 1.0 Pr Pr1 1 0.75000000 0.89336335 0.21158449 1.0 Pr Pr2 1 0.25000000 0.28061244 0.10096623 1.0 Pr Pr3 1 0.75000000 0.71938756 0.89903377 1.0 Y Y4 1 0.25000000 0.51894560 0.29376156 1.0 Y Y5 1 0.75000000 0.48105440 0.70623844 1.0 Y Y6 1 0.25000000 0.20945892 0.43934631 1.0 Y Y7 1 0.75000000 0.79054108 0.56065369 1.0 P P8 1 0.25000000 0.05272104 0.09964780 1.0 P P9 1 0.75000000 0.94727896 0.90035220 1.0 P P10 1 0.25000000 0.31728996 0.68656784 1.0 P P11 1 0.75000000 0.68271004 0.31343216 1.0 P P12 1 0.25000000 0.60935978 0.56385739 1.0 P P13 1 0.75000000 0.39064022 0.43614261 1.0 P P14 1 0.25000000 0.84240209 0.71621845 1.0 P P15 1 0.75000000 0.15759791 0.28378155 1.0 P P16 1 0.75000000 0.25774430 0.91586934 1.0 P P17 1 0.25000000 0.74225570 0.08413066 1.0 P P18 1 0.75000000 0.09124492 0.58913531 1.0 P P19 1 0.25000000 0.90875508 0.41086469 1.0 P P20 1 0.75000000 0.47055344 0.12958020 1.0 P P21 1 0.25000000 0.52944656 0.87041980 1.0 Ir Ir22 1 0.25000000 0.98947910 0.57573205 1.0 Ir Ir23 1 0.75000000 0.01052090 0.42426795 1.0 Ir Ir24 1 0.25000000 0.66110535 0.72567558 1.0 Ir Ir25 1 0.75000000 0.33889465 0.27432442 1.0 Ir Ir26 1 0.25000000 0.54753364 0.05207155 1.0 Ir Ir27 1 0.75000000 0.45246636 0.94792845 1.0 Ir Ir28 1 0.25000000 0.06391052 0.27367548 1.0 Ir Ir29 1 0.75000000 0.93608948 0.72632452 1.0 Ir Ir30 1 0.25000000 0.42296537 0.52356079 1.0 Ir Ir31 1 0.75000000 0.57703463 0.47643921 1.0 Ir Ir32 1 0.25000000 0.91523626 0.99866649 1.0 Ir Ir33 1 0.75000000 0.08476374 0.00133351 1.0 Ir Ir34 1 0.25000000 0.72915280 0.39735533 1.0 Ir Ir35 1 0.75000000 0.27084720 0.60264467 1.0 Ir Ir36 1 0.25000000 0.34386518 0.85653122 1.0 Ir Ir37 1 0.75000000 0.65613482 0.14346878 1.0