# generated using pymatgen data_YZr(BRu)8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.41565483 _cell_length_b 7.41565415 _cell_length_c 9.11731070 _cell_angle_alpha 113.99644845 _cell_angle_beta 113.99644678 _cell_angle_gamma 89.99999384 _symmetry_Int_Tables_number 1 _chemical_formula_structural YZr(BRu)8 _chemical_formula_sum 'Y2 Zr2 B16 Ru16' _cell_volume 410.15790781 _cell_formula_units_Z 2 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 Y Y0 1 0.25000000 0.25000000 0.49999900 1.0 Y Y1 1 0.74999900 0.74999900 0.49999900 1.0 Zr Zr2 1 0.50000000 0.00000000 0.00000000 1.0 Zr Zr3 1 0.00000000 0.50000000 0.00000000 1.0 B B4 1 0.25453759 0.21816279 0.16518102 1.0 B B5 1 0.75453859 0.44701724 0.16518102 1.0 B B6 1 0.41064243 0.71816279 0.16518102 1.0 B B7 1 0.91064243 0.94701724 0.16518102 1.0 B B8 1 0.83417953 0.02575797 0.33919980 1.0 B B9 1 0.50502027 0.31344183 0.33919980 1.0 B B10 1 0.00502027 0.52575697 0.33919980 1.0 B B11 1 0.33417853 0.81344183 0.33919980 1.0 B B12 1 0.68655817 0.16582147 0.66080120 1.0 B B13 1 0.97424203 0.49497973 0.66080120 1.0 B B14 1 0.47424303 0.66582147 0.66080120 1.0 B B15 1 0.18655817 0.99498073 0.66080120 1.0 B B16 1 0.78183721 0.08935757 0.83481898 1.0 B B17 1 0.28183721 0.24546241 0.83481898 1.0 B B18 1 0.55298276 0.58935757 0.83481898 1.0 B B19 1 0.05298276 0.74546241 0.83481898 1.0 Ru Ru20 1 0.94844545 0.21620597 0.12004940 1.0 Ru Ru21 1 0.44844545 0.40384343 0.12004940 1.0 Ru Ru22 1 0.67160295 0.71620597 0.12004940 1.0 Ru Ru23 1 0.17160395 0.90384343 0.12004940 1.0 Ru Ru24 1 0.56967190 0.04187514 0.37318544 1.0 Ru Ru25 1 0.80351355 0.33131031 0.37318544 1.0 Ru Ru26 1 0.30351355 0.54187414 0.37318544 1.0 Ru Ru27 1 0.06967190 0.83130931 0.37318544 1.0 Ru Ru28 1 0.95812486 0.19648645 0.62681456 1.0 Ru Ru29 1 0.66868969 0.43032810 0.62681456 1.0 Ru Ru30 1 0.16869069 0.69648645 0.62681456 1.0 Ru Ru31 1 0.45812486 0.93032810 0.62681456 1.0 Ru Ru32 1 0.09615657 0.05155455 0.87995060 1.0 Ru Ru33 1 0.59615657 0.32839605 0.87995060 1.0 Ru Ru34 1 0.28379403 0.55155355 0.87995060 1.0 Ru Ru35 1 0.78379403 0.82839605 0.87995060 1.0