# generated using pymatgen data_Tb4MgIr _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.71825611 _cell_length_b 9.71817958 _cell_length_c 9.71824781 _cell_angle_alpha 59.99935651 _cell_angle_beta 59.99969610 _cell_angle_gamma 59.99932455 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tb4MgIr _chemical_formula_sum 'Tb16 Mg4 Ir4' _cell_volume 648.99433434 _cell_formula_units_Z 4 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 Tb Tb0 1 0.18775167 0.81224531 0.81225097 1.0 Tb Tb1 1 0.81224834 0.18774697 0.18775932 1.0 Tb Tb2 1 0.06245719 0.43754216 0.06246311 1.0 Tb Tb3 1 0.03812195 0.65395546 0.65395619 1.0 Tb Tb4 1 0.65396618 0.65395588 0.65395646 1.0 Tb Tb5 1 0.06245458 0.06246704 0.43753675 1.0 Tb Tb6 1 0.18774777 0.81224576 0.18775617 1.0 Tb Tb7 1 0.81225054 0.81224455 0.18775727 1.0 Tb Tb8 1 0.81224722 0.18775157 0.81224665 1.0 Tb Tb9 1 0.43754313 0.06246610 0.43753882 1.0 Tb Tb10 1 0.43753869 0.43754349 0.06246216 1.0 Tb Tb11 1 0.43753656 0.06246675 0.06245971 1.0 Tb Tb12 1 0.06245717 0.43754837 0.43753882 1.0 Tb Tb13 1 0.18775476 0.18775132 0.81224788 1.0 Tb Tb14 1 0.65396169 0.65395158 0.03812333 1.0 Tb Tb15 1 0.65396390 0.03811789 0.65395311 1.0 Mg Mg16 1 0.42111137 0.42111819 0.73666038 1.0 Mg Mg17 1 0.42110937 0.73667336 0.42110979 1.0 Mg Mg18 1 0.42111219 0.42111976 0.42111258 1.0 Mg Mg19 1 0.73666240 0.42111778 0.42111129 1.0 Ir Ir20 1 0.85881466 0.85880112 0.42357176 1.0 Ir Ir21 1 0.85880958 0.42356685 0.85881173 1.0 Ir Ir22 1 0.85880905 0.85880252 0.85881015 1.0 Ir Ir23 1 0.42357606 0.85880221 0.85880860 1.0