# generated using pymatgen data_Tm20Zn3Cd3Ru2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.36631629 _cell_length_b 9.36631660 _cell_length_c 9.46604813 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000592 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tm20Zn3Cd3Ru2 _chemical_formula_sum 'Tm20 Zn3 Cd3 Ru2' _cell_volume 719.17894993 _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 0.00000000 0.00000000 0.47320528 1.0 Tm Tm1 1 0.00000000 0.00000000 0.02679472 1.0 Tm Tm2 1 0.20845811 0.79154189 0.43834338 1.0 Tm Tm3 1 0.20845811 0.41691621 0.43834338 1.0 Tm Tm4 1 0.58308379 0.79154189 0.43834338 1.0 Tm Tm5 1 0.79065715 0.20934285 0.55712289 1.0 Tm Tm6 1 0.79065715 0.58131430 0.55712289 1.0 Tm Tm7 1 0.41868570 0.20934285 0.55712289 1.0 Tm Tm8 1 0.79065715 0.20934285 0.94287711 1.0 Tm Tm9 1 0.79065715 0.58131430 0.94287711 1.0 Tm Tm10 1 0.41868570 0.20934285 0.94287711 1.0 Tm Tm11 1 0.20845811 0.79154189 0.06165662 1.0 Tm Tm12 1 0.20845811 0.41691621 0.06165662 1.0 Tm Tm13 1 0.58308379 0.79154189 0.06165662 1.0 Tm Tm14 1 0.54158748 0.45841252 0.25000000 1.0 Tm Tm15 1 0.54158748 0.08317597 0.25000000 1.0 Tm Tm16 1 0.91682403 0.45841252 0.25000000 1.0 Tm Tm17 1 0.45885351 0.54114649 0.75000000 1.0 Tm Tm18 1 0.45885351 0.91770701 0.75000000 1.0 Tm Tm19 1 0.08229299 0.54114649 0.75000000 1.0 Zn Zn20 1 0.87744937 0.12255063 0.25000000 1.0 Zn Zn21 1 0.87744937 0.75490075 0.25000000 1.0 Zn Zn22 1 0.24509925 0.12255063 0.25000000 1.0 Cd Cd23 1 0.11002285 0.88997715 0.75000000 1.0 Cd Cd24 1 0.11002285 0.22004469 0.75000000 1.0 Cd Cd25 1 0.77995531 0.88997715 0.75000000 1.0 Ru Ru26 1 0.33333300 0.66666700 0.25000000 1.0 Ru Ru27 1 0.66666700 0.33333300 0.75000000 1.0