# generated using pymatgen data_Tm20Cd6NiRu _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.46215473 _cell_length_b 9.46215511 _cell_length_c 9.53406243 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999516 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tm20Cd6NiRu _chemical_formula_sum 'Tm20 Cd6 Ni1 Ru1' _cell_volume 739.24560834 _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 0.50020127 1.0 Tm Tm1 1 0.00000000 0.00000000 0.99979873 1.0 Tm Tm2 1 0.54152396 0.45847604 0.25000000 1.0 Tm Tm3 1 0.54152396 0.08304792 0.25000000 1.0 Tm Tm4 1 0.91695208 0.45847604 0.25000000 1.0 Tm Tm5 1 0.45693824 0.54306176 0.75000000 1.0 Tm Tm6 1 0.45693824 0.91387748 0.75000000 1.0 Tm Tm7 1 0.08612252 0.54306176 0.75000000 1.0 Tm Tm8 1 0.20990945 0.79009055 0.43976122 1.0 Tm Tm9 1 0.20990945 0.41981891 0.43976122 1.0 Tm Tm10 1 0.58018109 0.79009055 0.43976122 1.0 Tm Tm11 1 0.78886628 0.21113372 0.56340347 1.0 Tm Tm12 1 0.78886628 0.57773355 0.56340347 1.0 Tm Tm13 1 0.42226645 0.21113372 0.56340347 1.0 Tm Tm14 1 0.78886628 0.21113372 0.93659653 1.0 Tm Tm15 1 0.78886628 0.57773355 0.93659653 1.0 Tm Tm16 1 0.42226645 0.21113372 0.93659653 1.0 Tm Tm17 1 0.20990945 0.79009055 0.06023878 1.0 Tm Tm18 1 0.20990945 0.41981891 0.06023878 1.0 Tm Tm19 1 0.58018109 0.79009055 0.06023878 1.0 Cd Cd20 1 0.88524042 0.11475958 0.25000000 1.0 Cd Cd21 1 0.88524042 0.77048084 0.25000000 1.0 Cd Cd22 1 0.22951916 0.11475958 0.25000000 1.0 Cd Cd23 1 0.11505629 0.88494371 0.75000000 1.0 Cd Cd24 1 0.11505629 0.23011257 0.75000000 1.0 Cd Cd25 1 0.76988743 0.88494371 0.75000000 1.0 Ni Ni26 1 0.66666700 0.33333300 0.75000000 1.0 Ru Ru27 1 0.33333300 0.66666700 0.25000000 1.0