# generated using pymatgen data_Tb3Tm(ThRu)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.35879068 _cell_length_b 7.21139327 _cell_length_c 9.58082726 _cell_angle_alpha 90.09000825 _cell_angle_beta 90.30940797 _cell_angle_gamma 89.84630623 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tb3Tm(ThRu)2 _chemical_formula_sum 'Tb6 Tm2 Th4 Ru4' _cell_volume 439.32740809 _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 Tb Tb0 1 0.17214146 0.17278358 0.06717242 1.0 Tb Tb1 1 0.82785854 0.82721642 0.93282758 1.0 Tb Tb2 1 0.67191007 0.32788930 0.93135555 1.0 Tb Tb3 1 0.82726982 0.82774447 0.56623095 1.0 Tb Tb4 1 0.32808993 0.67211070 0.06864445 1.0 Tb Tb5 1 0.17273018 0.17225553 0.43376905 1.0 Tm Tm6 1 0.32965024 0.67147611 0.43323302 1.0 Tm Tm7 1 0.67034976 0.32852389 0.56676698 1.0 Th Th8 1 0.65221652 0.04925468 0.25117274 1.0 Th Th9 1 0.34778348 0.95074532 0.74882726 1.0 Th Th10 1 0.15061183 0.45074801 0.74780711 1.0 Th Th11 1 0.84938817 0.54925199 0.25219289 1.0 Ru Ru12 1 0.47481125 0.37000907 0.25603219 1.0 Ru Ru13 1 0.52518875 0.62999093 0.74396781 1.0 Ru Ru14 1 0.97136727 0.13292247 0.74816838 1.0 Ru Ru15 1 0.02863273 0.86707753 0.25183162 1.0