# generated using pymatgen data_Tm20Cd3Ru2Au3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.37069397 _cell_length_b 9.37069183 _cell_length_c 9.43620637 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000753 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tm20Cd3Ru2Au3 _chemical_formula_sum 'Tm20 Cd3 Ru2 Au3' _cell_volume 717.58184026 _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 0.46247011 1.0 Tm Tm1 1 0.00000000 0.00000000 0.03752989 1.0 Tm Tm2 1 0.20890517 0.79109483 0.43900645 1.0 Tm Tm3 1 0.20890517 0.41781134 0.43900645 1.0 Tm Tm4 1 0.58218866 0.79109483 0.43900645 1.0 Tm Tm5 1 0.79165099 0.20834901 0.55772485 1.0 Tm Tm6 1 0.79165099 0.58330099 0.55772485 1.0 Tm Tm7 1 0.41669901 0.20834901 0.55772485 1.0 Tm Tm8 1 0.79165099 0.20834901 0.94227515 1.0 Tm Tm9 1 0.79165099 0.58330099 0.94227515 1.0 Tm Tm10 1 0.41669901 0.20834901 0.94227515 1.0 Tm Tm11 1 0.20890517 0.79109483 0.06099355 1.0 Tm Tm12 1 0.20890517 0.41781134 0.06099355 1.0 Tm Tm13 1 0.58218866 0.79109483 0.06099355 1.0 Tm Tm14 1 0.54108602 0.45891398 0.25000000 1.0 Tm Tm15 1 0.54108602 0.08217205 0.25000000 1.0 Tm Tm16 1 0.91782795 0.45891398 0.25000000 1.0 Tm Tm17 1 0.45891403 0.54108597 0.75000000 1.0 Tm Tm18 1 0.45891403 0.91782905 0.75000000 1.0 Tm Tm19 1 0.08217095 0.54108597 0.75000000 1.0 Cd Cd20 1 0.10950758 0.89049242 0.75000000 1.0 Cd Cd21 1 0.10950758 0.21901516 0.75000000 1.0 Cd Cd22 1 0.78098484 0.89049242 0.75000000 1.0 Ru Ru23 1 0.33333300 0.66666700 0.25000000 1.0 Ru Ru24 1 0.66666700 0.33333300 0.75000000 1.0 Au Au25 1 0.87081824 0.12918176 0.25000000 1.0 Au Au26 1 0.87081824 0.74163649 0.25000000 1.0 Au Au27 1 0.25836351 0.12918176 0.25000000 1.0