# generated using pymatgen data_Tb4NiB14 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.24172315 _cell_length_b 7.24172315 _cell_length_c 7.50980428 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tb4NiB14 _chemical_formula_sum 'Tb8 Ni2 B28' _cell_volume 393.83331804 _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 0.19355560 0.33068462 0.00000000 1.0 Tb Tb1 1 0.66931538 0.19355560 0.00000000 1.0 Tb Tb2 1 0.33068462 0.80644440 0.00000000 1.0 Tb Tb3 1 0.69355560 0.16931538 0.50000000 1.0 Tb Tb4 1 0.30644440 0.83068462 0.50000000 1.0 Tb Tb5 1 0.80644440 0.66931538 0.00000000 1.0 Tb Tb6 1 0.83068462 0.69355560 0.50000000 1.0 Tb Tb7 1 0.16931538 0.30644440 0.50000000 1.0 Ni Ni8 1 0.00000000 0.00000000 0.00000000 1.0 Ni Ni9 1 0.50000000 0.50000000 0.50000000 1.0 B B10 1 0.17369654 0.03918115 0.23186145 1.0 B B11 1 0.96081885 0.17369654 0.23186145 1.0 B B12 1 0.03918115 0.82630346 0.23186145 1.0 B B13 1 0.67369654 0.46081885 0.26813855 1.0 B B14 1 0.32630346 0.53918115 0.26813855 1.0 B B15 1 0.82630346 0.96081885 0.23186145 1.0 B B16 1 0.53918115 0.67369654 0.26813855 1.0 B B17 1 0.46081885 0.32630346 0.26813855 1.0 B B18 1 0.82630346 0.96081885 0.76813855 1.0 B B19 1 0.03918115 0.82630346 0.76813855 1.0 B B20 1 0.96081885 0.17369654 0.76813855 1.0 B B21 1 0.32630346 0.53918115 0.73186145 1.0 B B22 1 0.67369654 0.46081885 0.73186145 1.0 B B23 1 0.17369654 0.03918115 0.76813855 1.0 B B24 1 0.46081885 0.32630346 0.73186145 1.0 B B25 1 0.53918115 0.67369654 0.73186145 1.0 B B26 1 0.08977897 0.58977897 0.25000000 1.0 B B27 1 0.41022103 0.08977897 0.25000000 1.0 B B28 1 0.58977897 0.91022103 0.25000000 1.0 B B29 1 0.91022103 0.41022103 0.25000000 1.0 B B30 1 0.91022103 0.41022103 0.75000000 1.0 B B31 1 0.58977897 0.91022103 0.75000000 1.0 B B32 1 0.41022103 0.08977897 0.75000000 1.0 B B33 1 0.08977897 0.58977897 0.75000000 1.0 B B34 1 0.00000000 0.00000000 0.38867858 1.0 B B35 1 0.50000000 0.50000000 0.11132142 1.0 B B36 1 0.00000000 0.00000000 0.61132142 1.0 B B37 1 0.50000000 0.50000000 0.88867858 1.0