# generated using pymatgen data_TmThCdNi2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.44100947 _cell_length_b 7.44101035 _cell_length_c 3.62284633 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 93.16076502 _symmetry_Int_Tables_number 1 _chemical_formula_structural TmThCdNi2 _chemical_formula_sum 'Tm2 Th2 Cd2 Ni4' _cell_volume 200.28688302 _cell_formula_units_Z 2 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 0.17163692 0.32836308 0.50000000 1.0 Tm Tm1 1 0.82836308 0.67163692 0.50000000 1.0 Th Th2 1 0.67575266 0.17575266 0.50000000 1.0 Th Th3 1 0.32424734 0.82424734 0.50000000 1.0 Cd Cd4 1 0.00000000 0.00000000 0.00000000 1.0 Cd Cd5 1 0.50000000 0.50000000 0.00000000 1.0 Ni Ni6 1 0.12104063 0.62104063 0.00000000 1.0 Ni Ni7 1 0.87895937 0.37895937 0.00000000 1.0 Ni Ni8 1 0.62214875 0.87785125 0.00000000 1.0 Ni Ni9 1 0.37785125 0.12214875 0.00000000 1.0