# generated using pymatgen data_TbNdReB6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.74457692 _cell_length_b 9.26717735 _cell_length_c 11.72093150 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural TbNdReB6 _chemical_formula_sum 'Tb4 Nd4 Re4 B24' _cell_volume 406.73576142 _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 0.94198745 0.36819340 1.0 Tb Tb1 1 0.00000000 0.05801255 0.63180660 1.0 Tb Tb2 1 0.00000000 0.44198745 0.13180660 1.0 Tb Tb3 1 0.00000000 0.55801255 0.86819340 1.0 Nd Nd4 1 0.00000000 0.32342802 0.41455103 1.0 Nd Nd5 1 0.00000000 0.67657198 0.58544897 1.0 Nd Nd6 1 0.00000000 0.82342802 0.08544897 1.0 Nd Nd7 1 0.00000000 0.17657198 0.91455103 1.0 Re Re8 1 0.00000000 0.63874295 0.31946713 1.0 Re Re9 1 0.00000000 0.36125705 0.68053287 1.0 Re Re10 1 0.00000000 0.13874295 0.18053287 1.0 Re Re11 1 0.00000000 0.86125705 0.81946713 1.0 B B12 1 0.50000000 0.55500709 0.43039273 1.0 B B13 1 0.50000000 0.44499291 0.56960727 1.0 B B14 1 0.50000000 0.05500709 0.06960727 1.0 B B15 1 0.50000000 0.94499291 0.93039273 1.0 B B16 1 0.50000000 0.74865471 0.41528791 1.0 B B17 1 0.50000000 0.25134529 0.58471209 1.0 B B18 1 0.50000000 0.24865471 0.08471209 1.0 B B19 1 0.50000000 0.75134529 0.91528791 1.0 B B20 1 0.50000000 0.78996500 0.26575983 1.0 B B21 1 0.50000000 0.21003500 0.73424017 1.0 B B22 1 0.50000000 0.28996500 0.23424017 1.0 B B23 1 0.50000000 0.71003500 0.76575983 1.0 B B24 1 0.50000000 0.62945351 0.18697868 1.0 B B25 1 0.50000000 0.37054649 0.81302132 1.0 B B26 1 0.50000000 0.12945351 0.31302132 1.0 B B27 1 0.50000000 0.87054649 0.68697868 1.0 B B28 1 0.50000000 0.98453083 0.21247086 1.0 B B29 1 0.50000000 0.01546917 0.78752914 1.0 B B30 1 0.50000000 0.48453083 0.28752914 1.0 B B31 1 0.50000000 0.51546917 0.71247086 1.0 B B32 1 0.50000000 0.59579786 0.02662710 1.0 B B33 1 0.50000000 0.40420214 0.97337290 1.0 B B34 1 0.50000000 0.09579786 0.47337290 1.0 B B35 1 0.50000000 0.90420214 0.52662710 1.0