# generated using pymatgen data_Tm20Ir9RuRh2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.63587287 _cell_length_b 10.63587287 _cell_length_c 6.29967150 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tm20Ir9RuRh2 _chemical_formula_sum 'Tm20 Ir9 Ru1 Rh2' _cell_volume 712.63012671 _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 Tm Tm0 1 0.29056927 0.08833756 0.38103055 1.0 Tm Tm1 1 0.29045883 0.91240508 0.88156704 1.0 Tm Tm2 1 0.70954117 0.08759492 0.88156704 1.0 Tm Tm3 1 0.70943073 0.91166244 0.38103055 1.0 Tm Tm4 1 0.58759492 0.79045883 0.88156704 1.0 Tm Tm5 1 0.58833756 0.20943073 0.38103055 1.0 Tm Tm6 1 0.41166244 0.79056927 0.38103055 1.0 Tm Tm7 1 0.41240508 0.20954117 0.88156704 1.0 Tm Tm8 1 0.20736190 0.41315948 0.61942059 1.0 Tm Tm9 1 0.20666950 0.58726579 0.11612538 1.0 Tm Tm10 1 0.79333050 0.41273421 0.11612538 1.0 Tm Tm11 1 0.79263810 0.58684052 0.61942059 1.0 Tm Tm12 1 0.91273421 0.70666950 0.11612538 1.0 Tm Tm13 1 0.91315948 0.29263810 0.61942059 1.0 Tm Tm14 1 0.08684052 0.70736190 0.61942059 1.0 Tm Tm15 1 0.08726579 0.29333050 0.11612538 1.0 Tm Tm16 1 0.00000000 0.00000000 0.50245249 1.0 Tm Tm17 1 0.00000000 0.00000000 0.00245754 1.0 Tm Tm18 1 0.50000000 0.50000000 0.00245754 1.0 Tm Tm19 1 0.50000000 0.50000000 0.50245249 1.0 Ir Ir20 1 0.84545454 0.15245453 0.25070736 1.0 Ir Ir21 1 0.84488312 0.84756008 0.75048759 1.0 Ir Ir22 1 0.15511688 0.15243992 0.75048759 1.0 Ir Ir23 1 0.15454546 0.84754547 0.25070736 1.0 Ir Ir24 1 0.65243992 0.34488312 0.75048759 1.0 Ir Ir25 1 0.65245453 0.65454546 0.25070736 1.0 Ir Ir26 1 0.34754547 0.34545454 0.25070736 1.0 Ir Ir27 1 0.34756008 0.65511688 0.75048759 1.0 Ir Ir28 1 0.00000000 0.50000000 0.36927099 1.0 Ru Ru29 1 0.00000000 0.50000000 0.86693421 1.0 Rh Rh30 1 0.50000000 0.00000000 0.12841560 1.0 Rh Rh31 1 0.50000000 0.00000000 0.62820108 1.0