# generated using pymatgen data_Tb5Hf3(ReB6)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.62121876 _cell_length_b 9.03740843 _cell_length_c 11.44142083 _cell_angle_alpha 90.02432896 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tb5Hf3(ReB6)4 _chemical_formula_sum 'Tb5 Hf3 Re4 B24' _cell_volume 374.43685791 _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 0.00000000 0.82230768 0.08630390 1.0 Tb Tb1 1 0.00000000 0.17714483 0.91382336 1.0 Tb Tb2 1 0.00000000 0.32187571 0.41452811 1.0 Tb Tb3 1 0.00000000 0.67881305 0.58548036 1.0 Tb Tb4 1 0.00000000 0.44459700 0.12726071 1.0 Hf Hf5 1 0.00000000 0.55646732 0.86892176 1.0 Hf Hf6 1 0.00000000 0.94486674 0.37384305 1.0 Hf Hf7 1 0.00000000 0.05544670 0.62722025 1.0 Re Re8 1 0.00000000 0.13483650 0.18389537 1.0 Re Re9 1 0.00000000 0.85985568 0.81587996 1.0 Re Re10 1 0.00000000 0.64519695 0.32174999 1.0 Re Re11 1 0.00000000 0.35890562 0.68101779 1.0 B B12 1 0.50000000 0.05151446 0.06816285 1.0 B B13 1 0.50000000 0.94452015 0.93164951 1.0 B B14 1 0.50000000 0.55567000 0.43364528 1.0 B B15 1 0.50000000 0.44551324 0.56740978 1.0 B B16 1 0.50000000 0.24684636 0.08317688 1.0 B B17 1 0.50000000 0.74774592 0.91602863 1.0 B B18 1 0.50000000 0.75402446 0.41923365 1.0 B B19 1 0.50000000 0.24735024 0.58190015 1.0 B B20 1 0.50000000 0.29094909 0.23650838 1.0 B B21 1 0.50000000 0.70568591 0.76358385 1.0 B B22 1 0.50000000 0.79580208 0.26700875 1.0 B B23 1 0.50000000 0.20540159 0.73455095 1.0 B B24 1 0.50000000 0.12825164 0.31756937 1.0 B B25 1 0.50000000 0.87102270 0.68275672 1.0 B B26 1 0.50000000 0.63334969 0.18636088 1.0 B B27 1 0.50000000 0.37008687 0.81542375 1.0 B B28 1 0.50000000 0.48461873 0.28874699 1.0 B B29 1 0.50000000 0.51771992 0.71304242 1.0 B B30 1 0.50000000 0.98057253 0.21522281 1.0 B B31 1 0.50000000 0.01829123 0.78564211 1.0 B B32 1 0.50000000 0.09980277 0.47384804 1.0 B B33 1 0.50000000 0.90137079 0.52752036 1.0 B B34 1 0.50000000 0.60303667 0.02263682 1.0 B B35 1 0.50000000 0.40054317 0.96844444 1.0