# generated using pymatgen data_HfUCrB6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.46826861 _cell_length_b 8.98330333 _cell_length_c 11.34382069 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural HfUCrB6 _chemical_formula_sum 'Hf4 U4 Cr4 B24' _cell_volume 353.43385065 _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 0.44441982 0.12763231 1.0 Hf Hf1 1 0.00000000 0.55558018 0.87236769 1.0 Hf Hf2 1 0.00000000 0.94441982 0.37236769 1.0 Hf Hf3 1 0.00000000 0.05558018 0.62763231 1.0 U U4 1 0.00000000 0.82178679 0.08560303 1.0 U U5 1 0.00000000 0.17821321 0.91439697 1.0 U U6 1 0.00000000 0.32178679 0.41439697 1.0 U U7 1 0.00000000 0.67821321 0.58560303 1.0 Cr Cr8 1 0.00000000 0.14171517 0.18160470 1.0 Cr Cr9 1 0.00000000 0.85828483 0.81839530 1.0 Cr Cr10 1 0.00000000 0.64171517 0.31839530 1.0 Cr Cr11 1 0.00000000 0.35828483 0.68160470 1.0 B B12 1 0.50000000 0.05336404 0.06736231 1.0 B B13 1 0.50000000 0.94663596 0.93263769 1.0 B B14 1 0.50000000 0.55336404 0.43263769 1.0 B B15 1 0.50000000 0.44663596 0.56736231 1.0 B B16 1 0.50000000 0.25192785 0.08146614 1.0 B B17 1 0.50000000 0.74807215 0.91853386 1.0 B B18 1 0.50000000 0.75192785 0.41853386 1.0 B B19 1 0.50000000 0.24807215 0.58146614 1.0 B B20 1 0.50000000 0.29497913 0.23483692 1.0 B B21 1 0.50000000 0.70502087 0.76516308 1.0 B B22 1 0.50000000 0.79497913 0.26516308 1.0 B B23 1 0.50000000 0.20502087 0.73483692 1.0 B B24 1 0.50000000 0.13131411 0.31678243 1.0 B B25 1 0.50000000 0.86868589 0.68321757 1.0 B B26 1 0.50000000 0.63131411 0.18321757 1.0 B B27 1 0.50000000 0.36868589 0.81678243 1.0 B B28 1 0.50000000 0.48212947 0.28641089 1.0 B B29 1 0.50000000 0.51787053 0.71358911 1.0 B B30 1 0.50000000 0.98212947 0.21358911 1.0 B B31 1 0.50000000 0.01787053 0.78641089 1.0 B B32 1 0.50000000 0.10057840 0.47289401 1.0 B B33 1 0.50000000 0.89942160 0.52710599 1.0 B B34 1 0.50000000 0.60057840 0.02710599 1.0 B B35 1 0.50000000 0.39942160 0.97289401 1.0