# generated using pymatgen data_Yb3RuBr2O5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.73896225 _cell_length_b 6.73896210 _cell_length_c 10.69037506 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 132.61897041 _symmetry_Int_Tables_number 1 _chemical_formula_structural Yb3RuBr2O5 _chemical_formula_sum 'Yb6 Ru2 Br4 O10' _cell_volume 357.25787462 _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 Yb Yb0 1 0.87895210 0.12104790 0.75000000 1.0 Yb Yb1 1 0.66433737 0.33566263 0.52893438 1.0 Yb Yb2 1 0.33566263 0.66433737 0.47106562 1.0 Yb Yb3 1 0.66433737 0.33566263 0.97106562 1.0 Yb Yb4 1 0.33566263 0.66433737 0.02893438 1.0 Yb Yb5 1 0.12104790 0.87895210 0.25000000 1.0 Ru Ru6 1 0.77322268 0.22677732 0.25000000 1.0 Ru Ru7 1 0.22677732 0.77322268 0.75000000 1.0 Br Br8 1 0.49647131 0.50352869 0.25000000 1.0 Br Br9 1 0.50352869 0.49647131 0.75000000 1.0 Br Br10 1 0.00000000 0.00000000 0.50000000 1.0 Br Br11 1 0.00000000 0.00000000 0.00000000 1.0 O O12 1 0.09303159 0.90696841 0.75000000 1.0 O O13 1 0.03807815 0.48719305 0.63015600 1.0 O O14 1 0.48719305 0.03807815 0.36984400 1.0 O O15 1 0.51280695 0.96192185 0.63015600 1.0 O O16 1 0.96192185 0.51280695 0.36984400 1.0 O O17 1 0.90696841 0.09303159 0.25000000 1.0 O O18 1 0.03807815 0.48719305 0.86984400 1.0 O O19 1 0.51280695 0.96192185 0.86984400 1.0 O O20 1 0.96192185 0.51280695 0.13015600 1.0 O O21 1 0.48719305 0.03807815 0.13015600 1.0