# generated using pymatgen data_YbPa3(ZnIr)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.92798171 _cell_length_b 6.99007278 _cell_length_c 8.22117739 _cell_angle_alpha 90.07107230 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural YbPa3(ZnIr)4 _chemical_formula_sum 'Yb1 Pa3 Zn4 Ir4' _cell_volume 225.72769145 _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 Yb Yb0 1 0.25000000 0.05510367 0.31191841 1.0 Pa Pa1 1 0.25000000 0.55556634 0.19093512 1.0 Pa Pa2 1 0.75000000 0.45065792 0.81326098 1.0 Pa Pa3 1 0.75000000 0.95025901 0.68288785 1.0 Zn Zn4 1 0.25000000 0.61868782 0.55612939 1.0 Zn Zn5 1 0.75000000 0.36188319 0.43983015 1.0 Zn Zn6 1 0.75000000 0.88773481 0.06466798 1.0 Zn Zn7 1 0.25000000 0.11726387 0.94762496 1.0 Ir Ir8 1 0.25000000 0.73631531 0.86569663 1.0 Ir Ir9 1 0.75000000 0.28304616 0.11757398 1.0 Ir Ir10 1 0.75000000 0.74665677 0.36757943 1.0 Ir Ir11 1 0.25000000 0.23682613 0.64189211 1.0