# generated using pymatgen data_HoReB4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.60338044 _cell_length_b 5.95028903 _cell_length_c 11.50269971 _cell_angle_alpha 89.99991009 _cell_angle_beta 89.99999336 _cell_angle_gamma 90.00000492 _symmetry_Int_Tables_number 1 _chemical_formula_structural HoReB4 _chemical_formula_sum 'Ho4 Re4 B16' _cell_volume 246.63116859 _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 Ho Ho0 1 -0.00000010 0.62661927 0.15005395 1.0 Ho Ho1 1 -0.00000059 0.37337951 0.84994898 1.0 Ho Ho2 1 0.00000020 0.12661695 0.34992713 1.0 Ho Ho3 1 0.00000076 0.87338338 0.65007040 1.0 Re Re4 1 -0.00000032 0.63331496 0.41254373 1.0 Re Re5 1 0.00000049 0.36669018 0.58746148 1.0 Re Re6 1 -0.00000036 0.13327268 0.08739153 1.0 Re Re7 1 0.00000002 0.86672957 0.91260184 1.0 B B8 1 0.50000008 0.97743850 0.19229850 1.0 B B9 1 0.49999987 0.02255884 0.80769513 1.0 B B10 1 0.50000076 0.47741530 0.30768391 1.0 B B11 1 0.49999987 0.52258400 0.69232233 1.0 B B12 1 0.49999965 0.78785970 0.31522223 1.0 B B13 1 0.50000060 0.21213990 0.68478376 1.0 B B14 1 0.50000013 0.28783806 0.18476044 1.0 B B15 1 0.50000003 0.71216172 0.81523376 1.0 B B16 1 0.49999969 0.86352615 0.46874985 1.0 B B17 1 0.50000092 0.13647443 0.53126055 1.0 B B18 1 0.49999938 0.36350235 0.03125680 1.0 B B19 1 0.49999954 0.63649799 0.96873258 1.0 B B20 1 0.49999947 0.88589713 0.04751215 1.0 B B21 1 0.50000010 0.11410053 0.95247861 1.0 B B22 1 0.50000018 0.38588181 0.45248115 1.0 B B23 1 0.49999963 0.61411709 0.54752723 1.0