# generated using pymatgen data_TbLuReB6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.64374908 _cell_length_b 9.09878355 _cell_length_c 11.48661846 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural TbLuReB6 _chemical_formula_sum 'Tb4 Lu4 Re4 B24' _cell_volume 380.82372027 _cell_formula_units_Z 4 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 0.32313247 0.41412046 1.0 Tb Tb1 1 0.00000000 0.67686753 0.58587954 1.0 Tb Tb2 1 0.00000000 0.82313247 0.08587954 1.0 Tb Tb3 1 0.00000000 0.17686753 0.91412046 1.0 Lu Lu4 1 0.00000000 0.94305237 0.36937444 1.0 Lu Lu5 1 0.00000000 0.05694763 0.63062556 1.0 Lu Lu6 1 0.00000000 0.44305237 0.13062556 1.0 Lu Lu7 1 0.00000000 0.55694763 0.86937444 1.0 Re Re8 1 0.00000000 0.63970965 0.31933193 1.0 Re Re9 1 0.00000000 0.36029035 0.68066807 1.0 Re Re10 1 0.00000000 0.13970965 0.18066807 1.0 Re Re11 1 0.00000000 0.86029035 0.81933193 1.0 B B12 1 0.50000000 0.55409561 0.43215266 1.0 B B13 1 0.50000000 0.44590439 0.56784734 1.0 B B14 1 0.50000000 0.05409561 0.06784734 1.0 B B15 1 0.50000000 0.94590439 0.93215266 1.0 B B16 1 0.50000000 0.75136866 0.41782815 1.0 B B17 1 0.50000000 0.24863134 0.58217185 1.0 B B18 1 0.50000000 0.25136866 0.08217185 1.0 B B19 1 0.50000000 0.74863134 0.91782815 1.0 B B20 1 0.50000000 0.79294328 0.26497420 1.0 B B21 1 0.50000000 0.20705672 0.73502580 1.0 B B22 1 0.50000000 0.29294328 0.23502580 1.0 B B23 1 0.50000000 0.70705672 0.76497420 1.0 B B24 1 0.50000000 0.62986539 0.18472428 1.0 B B25 1 0.50000000 0.37013461 0.81527572 1.0 B B26 1 0.50000000 0.12986539 0.31527572 1.0 B B27 1 0.50000000 0.87013461 0.68472428 1.0 B B28 1 0.50000000 0.98228378 0.21281593 1.0 B B29 1 0.50000000 0.01771622 0.78718407 1.0 B B30 1 0.50000000 0.48228378 0.28718407 1.0 B B31 1 0.50000000 0.51771622 0.71281593 1.0 B B32 1 0.50000000 0.59700670 0.02675306 1.0 B B33 1 0.50000000 0.40299330 0.97324694 1.0 B B34 1 0.50000000 0.09700670 0.47324694 1.0 B B35 1 0.50000000 0.90299330 0.52675306 1.0