# generated using pymatgen data_Na3Y5(P7Ir8)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.93234340 _cell_length_b 12.52400554 _cell_length_c 13.10187058 _cell_angle_alpha 80.95025346 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Na3Y5(P7Ir8)2 _chemical_formula_sum 'Na3 Y5 P14 Ir16' _cell_volume 637.21799065 _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 Na Na0 1 0.25000000 0.10137438 0.79464641 1.0 Na Na1 1 0.75000000 0.89840830 0.20227688 1.0 Na Na2 1 0.25000000 0.28421394 0.10648345 1.0 Y Y3 1 0.75000000 0.79021975 0.56172411 1.0 Y Y4 1 0.25000000 0.21303574 0.43541491 1.0 Y Y5 1 0.75000000 0.47838044 0.70834947 1.0 Y Y6 1 0.25000000 0.52070441 0.29374023 1.0 Y Y7 1 0.75000000 0.71885253 0.89933672 1.0 P P8 1 0.25000000 0.91105680 0.41020223 1.0 P P9 1 0.75000000 0.47107507 0.13012286 1.0 P P10 1 0.25000000 0.52646919 0.87318993 1.0 P P11 1 0.75000000 0.09141517 0.58704829 1.0 P P12 1 0.25000000 0.73898015 0.07767672 1.0 P P13 1 0.75000000 0.25657305 0.92125302 1.0 P P14 1 0.75000000 0.15661541 0.27939690 1.0 P P15 1 0.25000000 0.84421121 0.71799660 1.0 P P16 1 0.25000000 0.05513267 0.09693167 1.0 P P17 1 0.75000000 0.94533425 0.89748012 1.0 P P18 1 0.25000000 0.30352288 0.69007610 1.0 P P19 1 0.75000000 0.69628677 0.31135406 1.0 P P20 1 0.25000000 0.60984893 0.56488371 1.0 P P21 1 0.75000000 0.39101233 0.43874685 1.0 Ir Ir22 1 0.25000000 0.98480110 0.57354673 1.0 Ir Ir23 1 0.75000000 0.01750907 0.42324875 1.0 Ir Ir24 1 0.25000000 0.66035639 0.73068859 1.0 Ir Ir25 1 0.75000000 0.34011402 0.27738345 1.0 Ir Ir26 1 0.25000000 0.55378185 0.04773738 1.0 Ir Ir27 1 0.75000000 0.44637644 0.95076157 1.0 Ir Ir28 1 0.25000000 0.06353341 0.26920328 1.0 Ir Ir29 1 0.75000000 0.93662893 0.72671719 1.0 Ir Ir30 1 0.25000000 0.42425755 0.52914958 1.0 Ir Ir31 1 0.75000000 0.57822390 0.47514267 1.0 Ir Ir32 1 0.25000000 0.91310878 0.99489858 1.0 Ir Ir33 1 0.75000000 0.08032590 0.99990928 1.0 Ir Ir34 1 0.25000000 0.72880925 0.39996506 1.0 Ir Ir35 1 0.75000000 0.27191865 0.60116362 1.0 Ir Ir36 1 0.25000000 0.33777173 0.85893469 1.0 Ir Ir37 1 0.75000000 0.65976065 0.14321736 1.0