# generated using pymatgen data_Tm20Ge2IrRu9 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.66308380 _cell_length_b 10.66308353 _cell_length_c 6.30295859 _cell_angle_alpha 89.52236830 _cell_angle_beta 89.52237389 _cell_angle_gamma 89.45445081 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tm20Ge2IrRu9 _chemical_formula_sum 'Tm20 Ge2 Ir1 Ru9' _cell_volume 716.57310484 _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 0.28765291 0.08481157 0.37702621 1.0 Tm Tm1 1 0.29115041 0.91221737 0.87757928 1.0 Tm Tm2 1 0.70180093 0.07453933 0.87012486 1.0 Tm Tm3 1 0.70320138 0.90799485 0.37712597 1.0 Tm Tm4 1 0.58465718 0.78878159 0.87802728 1.0 Tm Tm5 1 0.57470789 0.20087798 0.36943256 1.0 Tm Tm6 1 0.41170714 0.79164633 0.37917930 1.0 Tm Tm7 1 0.40777652 0.20360710 0.87746960 1.0 Tm Tm8 1 0.21121841 0.41534282 0.62197272 1.0 Tm Tm9 1 0.20835367 0.58829286 0.12082070 1.0 Tm Tm10 1 0.79912202 0.42529211 0.13056744 1.0 Tm Tm11 1 0.79639290 0.59222348 0.62253040 1.0 Tm Tm12 1 0.91518843 0.71234709 0.12297379 1.0 Tm Tm13 1 0.92546067 0.29819907 0.62987514 1.0 Tm Tm14 1 0.08778263 0.70884959 0.62242072 1.0 Tm Tm15 1 0.09200515 0.29679862 0.12287403 1.0 Tm Tm16 1 0.99977502 0.99744824 0.50212009 1.0 Tm Tm17 1 0.00255176 0.00022498 0.99787991 1.0 Tm Tm18 1 0.49902628 0.49921191 0.00241828 1.0 Tm Tm19 1 0.50078809 0.50097372 0.49758172 1.0 Ge Ge20 1 0.84158876 0.15841124 0.25000000 1.0 Ge Ge21 1 0.65948344 0.34051656 0.75000000 1.0 Ir Ir22 1 0.34746959 0.65253041 0.75000000 1.0 Ru Ru23 1 0.84643740 0.85017893 0.75096608 1.0 Ru Ru24 1 0.14982107 0.15356260 0.74903392 1.0 Ru Ru25 1 0.15308842 0.84691158 0.25000000 1.0 Ru Ru26 1 0.65246849 0.64963669 0.24941296 1.0 Ru Ru27 1 0.35036331 0.34753151 0.25058704 1.0 Ru Ru28 1 0.49525249 0.99664072 0.12671991 1.0 Ru Ru29 1 0.49686597 0.99651760 0.62665158 1.0 Ru Ru30 1 0.00348240 0.50313403 0.87334842 1.0 Ru Ru31 1 0.00335928 0.50474751 0.37328009 1.0