# generated using pymatgen data_Tb17Ho2MgIr12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.83399416 _cell_length_b 10.83399416 _cell_length_c 6.32479896 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tb17Ho2MgIr12 _chemical_formula_sum 'Tb17 Ho2 Mg1 Ir12' _cell_volume 742.37599382 _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 Tb Tb0 1 0.28284050 0.08400079 0.38401958 1.0 Tb Tb1 1 0.29126901 0.91061864 0.88428430 1.0 Tb Tb2 1 0.70873099 0.08938136 0.88428430 1.0 Tb Tb3 1 0.71715950 0.91599921 0.38401958 1.0 Tb Tb4 1 0.59005559 0.79201031 0.88512150 1.0 Tb Tb5 1 0.58623436 0.20834290 0.38205019 1.0 Tb Tb6 1 0.41376564 0.79165710 0.38205019 1.0 Tb Tb7 1 0.40994441 0.20798969 0.88512150 1.0 Tb Tb8 1 0.20834290 0.41376564 0.61794981 1.0 Tb Tb9 1 0.20798969 0.59005559 0.11487850 1.0 Tb Tb10 1 0.79201031 0.40994441 0.11487850 1.0 Tb Tb11 1 0.79165710 0.58623436 0.61794981 1.0 Tb Tb12 1 0.91061864 0.70873099 0.11571570 1.0 Tb Tb13 1 0.91599921 0.28284050 0.61598042 1.0 Tb Tb14 1 0.08400079 0.71715950 0.61598042 1.0 Tb Tb15 1 0.08938136 0.29126901 0.11571570 1.0 Tb Tb16 1 0.00000000 0.00000000 0.00000000 1.0 Ho Ho17 1 0.50000000 0.50000000 0.00000000 1.0 Ho Ho18 1 0.50000000 0.50000000 0.50000000 1.0 Mg Mg19 1 0.00000000 0.00000000 0.50000000 1.0 Ir Ir20 1 0.84713807 0.15456395 0.24736525 1.0 Ir Ir21 1 0.84543605 0.84713807 0.75263475 1.0 Ir Ir22 1 0.15456395 0.15286193 0.75263475 1.0 Ir Ir23 1 0.15286193 0.84543605 0.24736525 1.0 Ir Ir24 1 0.65239841 0.34669673 0.74814513 1.0 Ir Ir25 1 0.65330327 0.65239841 0.25185487 1.0 Ir Ir26 1 0.34669673 0.34760159 0.25185487 1.0 Ir Ir27 1 0.34760159 0.65330327 0.74814513 1.0 Ir Ir28 1 0.50000000 0.00000000 0.13001199 1.0 Ir Ir29 1 0.50000000 0.00000000 0.62537189 1.0 Ir Ir30 1 0.00000000 0.50000000 0.86998801 1.0 Ir Ir31 1 0.00000000 0.50000000 0.37462811 1.0