# generated using pymatgen data_HfUReB6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.59413119 _cell_length_b 9.00077534 _cell_length_c 11.38363063 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural HfUReB6 _chemical_formula_sum 'Hf4 U4 Re4 B24' _cell_volume 368.26007965 _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 Hf Hf0 1 0.00000000 0.94493958 0.37423600 1.0 Hf Hf1 1 0.00000000 0.05506042 0.62576400 1.0 Hf Hf2 1 0.00000000 0.44493958 0.12576400 1.0 Hf Hf3 1 0.00000000 0.55506042 0.87423600 1.0 U U4 1 0.00000000 0.32340545 0.41460079 1.0 U U5 1 0.00000000 0.67659455 0.58539921 1.0 U U6 1 0.00000000 0.82340545 0.08539921 1.0 U U7 1 0.00000000 0.17659455 0.91460079 1.0 Re Re8 1 0.00000000 0.64040897 0.31992753 1.0 Re Re9 1 0.00000000 0.35959103 0.68007247 1.0 Re Re10 1 0.00000000 0.14040897 0.18007247 1.0 Re Re11 1 0.00000000 0.85959103 0.81992753 1.0 B B12 1 0.50000000 0.55311155 0.43368890 1.0 B B13 1 0.50000000 0.44688845 0.56631110 1.0 B B14 1 0.50000000 0.05311155 0.06631110 1.0 B B15 1 0.50000000 0.94688845 0.93368890 1.0 B B16 1 0.50000000 0.75305976 0.41967713 1.0 B B17 1 0.50000000 0.24694024 0.58032287 1.0 B B18 1 0.50000000 0.25305976 0.08032287 1.0 B B19 1 0.50000000 0.74694024 0.91967713 1.0 B B20 1 0.50000000 0.79597766 0.26516414 1.0 B B21 1 0.50000000 0.20402234 0.73483586 1.0 B B22 1 0.50000000 0.29597766 0.23483586 1.0 B B23 1 0.50000000 0.70402234 0.76516414 1.0 B B24 1 0.50000000 0.63153969 0.18233926 1.0 B B25 1 0.50000000 0.36846031 0.81766074 1.0 B B26 1 0.50000000 0.13153969 0.31766074 1.0 B B27 1 0.50000000 0.86846031 0.68233926 1.0 B B28 1 0.50000000 0.98091757 0.21456898 1.0 B B29 1 0.50000000 0.01908243 0.78543102 1.0 B B30 1 0.50000000 0.48091757 0.28543102 1.0 B B31 1 0.50000000 0.51908243 0.71456898 1.0 B B32 1 0.50000000 0.60042498 0.02726821 1.0 B B33 1 0.50000000 0.39957502 0.97273179 1.0 B B34 1 0.50000000 0.10042498 0.47273179 1.0 B B35 1 0.50000000 0.89957502 0.52726821 1.0