# generated using pymatgen data_UFeB4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.37539600 _cell_length_b 5.87307400 _cell_length_c 11.38120300 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural UFeB4 _chemical_formula_sum 'U4 Fe4 B16' _cell_volume 225.62040476 _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 U U0 1 0.00000000 0.62742000 0.34956900 1.0 U U1 1 0.00000000 0.37258000 0.65043100 1.0 U U2 1 0.00000000 0.12742000 0.15043100 1.0 U U3 1 0.00000000 0.87258000 0.84956900 1.0 Fe Fe4 1 0.00000000 0.63478300 0.08889100 1.0 Fe Fe5 1 0.00000000 0.36521700 0.91110900 1.0 Fe Fe6 1 0.00000000 0.13478300 0.41110900 1.0 Fe Fe7 1 0.00000000 0.86521700 0.58889100 1.0 B B8 1 0.50000000 0.78373800 0.18678200 1.0 B B9 1 0.50000000 0.21626200 0.81321800 1.0 B B10 1 0.50000000 0.28373800 0.31321800 1.0 B B11 1 0.50000000 0.71626200 0.68678200 1.0 B B12 1 0.50000000 0.86497200 0.03408600 1.0 B B13 1 0.50000000 0.13502800 0.96591400 1.0 B B14 1 0.50000000 0.36497200 0.46591400 1.0 B B15 1 0.50000000 0.63502800 0.53408600 1.0 B B16 1 0.50000000 0.88636200 0.45428100 1.0 B B17 1 0.50000000 0.11363800 0.54571900 1.0 B B18 1 0.50000000 0.38636200 0.04571900 1.0 B B19 1 0.50000000 0.61363800 0.95428100 1.0 B B20 1 0.50000000 0.97576100 0.30872800 1.0 B B21 1 0.50000000 0.02423900 0.69127200 1.0 B B22 1 0.50000000 0.47576100 0.19127200 1.0 B B23 1 0.50000000 0.52423900 0.80872800 1.0