# generated using pymatgen data_Na2Tb2P7Ir8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.93499555 _cell_length_b 12.52960173 _cell_length_c 13.10063986 _cell_angle_alpha 80.32913188 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Na2Tb2P7Ir8 _chemical_formula_sum 'Na4 Tb4 P14 Ir16' _cell_volume 636.73392876 _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 Na Na0 1 0.75000000 0.71401184 0.89327772 1.0 Na Na1 1 0.25000000 0.09917083 0.79675652 1.0 Na Na2 1 0.75000000 0.90082917 0.20324348 1.0 Na Na3 1 0.25000000 0.28598816 0.10672228 1.0 Tb Tb4 1 0.75000000 0.78748711 0.56423806 1.0 Tb Tb5 1 0.25000000 0.21251289 0.43576194 1.0 Tb Tb6 1 0.75000000 0.48007646 0.70705346 1.0 Tb Tb7 1 0.25000000 0.51992354 0.29294654 1.0 P P8 1 0.25000000 0.91079198 0.41111350 1.0 P P9 1 0.75000000 0.47357376 0.12719335 1.0 P P10 1 0.25000000 0.52642624 0.87280665 1.0 P P11 1 0.75000000 0.08920802 0.58888650 1.0 P P12 1 0.25000000 0.74204116 0.07865453 1.0 P P13 1 0.75000000 0.25795884 0.92134547 1.0 P P14 1 0.75000000 0.15767887 0.27972434 1.0 P P15 1 0.25000000 0.84232113 0.72027566 1.0 P P16 1 0.25000000 0.05874633 0.09734477 1.0 P P17 1 0.75000000 0.94125367 0.90265523 1.0 P P18 1 0.25000000 0.30235294 0.69085241 1.0 P P19 1 0.75000000 0.69764706 0.30914759 1.0 P P20 1 0.25000000 0.60927576 0.56149784 1.0 P P21 1 0.75000000 0.39072424 0.43850216 1.0 Ir Ir22 1 0.25000000 0.98220727 0.57549166 1.0 Ir Ir23 1 0.75000000 0.01779273 0.42450834 1.0 Ir Ir24 1 0.25000000 0.65779556 0.72400473 1.0 Ir Ir25 1 0.75000000 0.34220444 0.27599527 1.0 Ir Ir26 1 0.25000000 0.55545426 0.04764273 1.0 Ir Ir27 1 0.75000000 0.44454574 0.95235727 1.0 Ir Ir28 1 0.25000000 0.06462558 0.26997607 1.0 Ir Ir29 1 0.75000000 0.93537442 0.73002393 1.0 Ir Ir30 1 0.25000000 0.42255018 0.52821827 1.0 Ir Ir31 1 0.75000000 0.57744982 0.47178173 1.0 Ir Ir32 1 0.25000000 0.91785132 0.99973002 1.0 Ir Ir33 1 0.75000000 0.08214868 0.00026998 1.0 Ir Ir34 1 0.25000000 0.72970625 0.39764472 1.0 Ir Ir35 1 0.75000000 0.27029375 0.60235528 1.0 Ir Ir36 1 0.25000000 0.33892610 0.85881810 1.0 Ir Ir37 1 0.75000000 0.66107390 0.14118190 1.0