# generated using pymatgen data_Tm20Ir7Ru3Au2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.74112720 _cell_length_b 10.68307268 _cell_length_c 6.31962992 _cell_angle_alpha 90.03581533 _cell_angle_beta 89.81793346 _cell_angle_gamma 90.03576762 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tm20Ir7Ru3Au2 _chemical_formula_sum 'Tm20 Ir7 Ru3 Au2' _cell_volume 725.16248343 _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 0.29213260 0.08595872 0.37740885 1.0 Tm Tm1 1 0.29208878 0.91440660 0.87746739 1.0 Tm Tm2 1 0.69509592 0.08987102 0.87076806 1.0 Tm Tm3 1 0.69508283 0.90988393 0.37011020 1.0 Tm Tm4 1 0.57578792 0.79297430 0.87904964 1.0 Tm Tm5 1 0.57614505 0.20721576 0.37916197 1.0 Tm Tm6 1 0.40962225 0.79322928 0.37967299 1.0 Tm Tm7 1 0.41025602 0.20666321 0.88031605 1.0 Tm Tm8 1 0.21103022 0.41255087 0.62020234 1.0 Tm Tm9 1 0.21026758 0.58749426 0.11734416 1.0 Tm Tm10 1 0.79310404 0.42014392 0.11846152 1.0 Tm Tm11 1 0.79300461 0.57975655 0.62142689 1.0 Tm Tm12 1 0.91930545 0.70412687 0.13191012 1.0 Tm Tm13 1 0.91960751 0.29536012 0.63691492 1.0 Tm Tm14 1 0.09519508 0.70308688 0.62121429 1.0 Tm Tm15 1 0.09537885 0.29717319 0.11911635 1.0 Tm Tm16 1 0.00623234 0.99765966 0.50038645 1.0 Tm Tm17 1 0.00610035 0.00235204 0.00013095 1.0 Tm Tm18 1 0.50173791 0.49872239 0.99784369 1.0 Tm Tm19 1 0.50193647 0.50149257 0.49779187 1.0 Ir Ir20 1 0.15173467 0.15334579 0.74936334 1.0 Ir Ir21 1 0.15098245 0.84644942 0.24891273 1.0 Ir Ir22 1 0.65617114 0.34683323 0.74661805 1.0 Ir Ir23 1 0.65649335 0.65293677 0.24649573 1.0 Ir Ir24 1 0.34859709 0.34741781 0.25013814 1.0 Ir Ir25 1 0.34841416 0.65280076 0.74973222 1.0 Ir Ir26 1 0.00263306 0.49917773 0.37660035 1.0 Ru Ru27 1 0.49759288 0.99999768 0.12762828 1.0 Ru Ru28 1 0.49757697 0.99993034 0.62732613 1.0 Ru Ru29 1 0.00279986 0.49998062 0.87488554 1.0 Au Au30 1 0.84445353 0.15510484 0.25313781 1.0 Au Au31 1 0.84344007 0.84590086 0.75245897 1.0