# generated using pymatgen data_TbHo4(Th3Ru2)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.69367074 _cell_length_b 9.80719825 _cell_length_c 6.41314094 _cell_angle_alpha 89.88450107 _cell_angle_beta 90.20999317 _cell_angle_gamma 120.35571434 _symmetry_Int_Tables_number 1 _chemical_formula_structural TbHo4(Th3Ru2)3 _chemical_formula_sum 'Tb1 Ho4 Th9 Ru6' _cell_volume 526.09458601 _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 Tb Tb0 1 0.45927251 0.53403273 0.29999425 1.0 Ho Ho1 1 0.07084535 0.53302588 0.30338714 1.0 Ho Ho2 1 0.92849432 0.46252476 0.80116068 1.0 Ho Ho3 1 0.25293773 0.12652595 0.51056022 1.0 Ho Ho4 1 0.54034774 0.07661148 0.79650269 1.0 Th Th5 1 0.74761022 0.87644253 0.01372000 1.0 Th Th6 1 0.66619442 0.33220761 0.26624364 1.0 Th Th7 1 0.12573070 0.87457450 0.00604303 1.0 Th Th8 1 0.45896374 0.92447859 0.30352352 1.0 Th Th9 1 0.53701006 0.46059439 0.79886796 1.0 Th Th10 1 0.88192162 0.13121415 0.51724142 1.0 Th Th11 1 0.12385538 0.24874894 0.01384084 1.0 Th Th12 1 0.87749564 0.74896512 0.50878045 1.0 Th Th13 1 0.33435433 0.66793983 0.76917867 1.0 Ru Ru14 1 0.81124592 0.63043056 0.04220440 1.0 Ru Ru15 1 0.82014375 0.18319302 0.05028369 1.0 Ru Ru16 1 0.63431102 0.82296062 0.53956416 1.0 Ru Ru17 1 0.36997489 0.18722935 0.03823318 1.0 Ru Ru18 1 0.17707993 0.37258806 0.55771225 1.0 Ru Ru19 1 0.18220974 0.80571193 0.54695381 1.0