# generated using pymatgen data_Tm20Ir7Ru5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.58294255 _cell_length_b 10.58294255 _cell_length_c 6.33032999 _cell_angle_alpha 89.98010695 _cell_angle_beta 89.98010695 _cell_angle_gamma 90.06408956 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tm20Ir7Ru5 _chemical_formula_sum 'Tm20 Ir7 Ru5' _cell_volume 708.98802942 _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 0.29373722 0.08594770 0.37891148 1.0 Tm Tm1 1 0.29294632 0.91425763 0.87931514 1.0 Tm Tm2 1 0.70763779 0.08632852 0.87811053 1.0 Tm Tm3 1 0.70745808 0.91440584 0.37780361 1.0 Tm Tm4 1 0.58589464 0.79358803 0.87870783 1.0 Tm Tm5 1 0.58696170 0.20697996 0.37900647 1.0 Tm Tm6 1 0.41426809 0.79382864 0.37900086 1.0 Tm Tm7 1 0.41420228 0.20657428 0.87892979 1.0 Tm Tm8 1 0.20641197 0.41410536 0.62129217 1.0 Tm Tm9 1 0.20617136 0.58573191 0.12099914 1.0 Tm Tm10 1 0.79302004 0.41303830 0.12099353 1.0 Tm Tm11 1 0.79342572 0.58579772 0.62107021 1.0 Tm Tm12 1 0.91405230 0.70626278 0.12108852 1.0 Tm Tm13 1 0.91367148 0.29236221 0.62188947 1.0 Tm Tm14 1 0.08574237 0.70705368 0.62068486 1.0 Tm Tm15 1 0.08559416 0.29254192 0.12219639 1.0 Tm Tm16 1 0.99968885 0.00119122 0.49892649 1.0 Tm Tm17 1 0.99880878 0.00031115 0.00107351 1.0 Tm Tm18 1 0.49971227 0.50022911 0.00001241 1.0 Tm Tm19 1 0.49977089 0.50028773 0.49998759 1.0 Ir Ir20 1 0.84740483 0.84614090 0.74917186 1.0 Ir Ir21 1 0.15385910 0.15259517 0.75082814 1.0 Ir Ir22 1 0.15309621 0.84690379 0.25000000 1.0 Ir Ir23 1 0.65184607 0.34815393 0.75000000 1.0 Ir Ir24 1 0.65268864 0.65275832 0.24966686 1.0 Ir Ir25 1 0.34724168 0.34731136 0.25033314 1.0 Ir Ir26 1 0.34707464 0.65292536 0.75000000 1.0 Ru Ru27 1 0.84754070 0.15245930 0.25000000 1.0 Ru Ru28 1 0.50061013 0.00031756 0.12984301 1.0 Ru Ru29 1 0.49995706 0.00017683 0.62984304 1.0 Ru Ru30 1 0.99982317 0.50004294 0.87015696 1.0 Ru Ru31 1 0.99968244 0.49938987 0.37015699 1.0