# generated using pymatgen data_Zr3Pa5Ir8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.52574869 _cell_length_b 5.57762105 _cell_length_c 5.57088342 _cell_angle_alpha 82.20170071 _cell_angle_beta 89.93884053 _cell_angle_gamma 90.12734244 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr3Pa5Ir8 _chemical_formula_sum 'Zr3 Pa5 Ir8' _cell_volume 324.03318065 _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 Zr Zr0 1 0.49840767 0.10428657 0.84869742 1.0 Zr Zr1 1 0.99965769 0.89509034 0.15152420 1.0 Zr Zr2 1 0.49907462 0.65484590 0.39408230 1.0 Pa Pa3 1 0.99206960 0.34171737 0.60643453 1.0 Pa Pa4 1 0.22359466 0.38433913 0.12126868 1.0 Pa Pa5 1 0.71190329 0.61680342 0.87991368 1.0 Pa Pa6 1 0.22474607 0.85884373 0.63292295 1.0 Pa Pa7 1 0.71075860 0.14307013 0.36487771 1.0 Ir Ir8 1 0.75915584 0.11568175 0.86958445 1.0 Ir Ir9 1 0.26480023 0.88318402 0.13188697 1.0 Ir Ir10 1 0.75925997 0.64579144 0.37586404 1.0 Ir Ir11 1 0.26359450 0.36028839 0.62335359 1.0 Ir Ir12 1 0.95499705 0.39989012 0.09908610 1.0 Ir Ir13 1 0.45567485 0.59239664 0.90720827 1.0 Ir Ir14 1 0.95975742 0.83409431 0.65998181 1.0 Ir Ir15 1 0.45855195 0.16967474 0.33331131 1.0