# generated using pymatgen data_Yb3Al12IrOs3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.79134743 _cell_length_b 8.79134718 _cell_length_c 9.52357563 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.95839504 _symmetry_Int_Tables_number 1 _chemical_formula_structural Yb3Al12IrOs3 _chemical_formula_sum 'Yb6 Al24 Ir2 Os6' _cell_volume 637.71034414 _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 0.19052331 0.38734958 0.25000000 1.0 Yb Yb1 1 0.80947669 0.61265042 0.75000000 1.0 Yb Yb2 1 0.61265042 0.80947669 0.25000000 1.0 Yb Yb3 1 0.38734958 0.19052331 0.75000000 1.0 Yb Yb4 1 0.19490880 0.80509120 0.25000000 1.0 Yb Yb5 1 0.80509120 0.19490880 0.75000000 1.0 Al Al6 1 0.33306177 0.66693823 0.99735102 1.0 Al Al7 1 0.66693823 0.33306177 0.00264898 1.0 Al Al8 1 0.66693823 0.33306177 0.49735102 1.0 Al Al9 1 0.33306177 0.66693823 0.50264898 1.0 Al Al10 1 0.16122188 0.32359213 0.57484735 1.0 Al Al11 1 0.83877812 0.67640787 0.42515265 1.0 Al Al12 1 0.67640787 0.83877812 0.57484735 1.0 Al Al13 1 0.83877812 0.67640787 0.07484735 1.0 Al Al14 1 0.32359213 0.16122188 0.42515265 1.0 Al Al15 1 0.16122188 0.32359213 0.92515265 1.0 Al Al16 1 0.16212753 0.83787247 0.57178108 1.0 Al Al17 1 0.32359213 0.16122188 0.07484735 1.0 Al Al18 1 0.83787247 0.16212753 0.42821892 1.0 Al Al19 1 0.67640787 0.83877812 0.92515265 1.0 Al Al20 1 0.83787247 0.16212753 0.07178108 1.0 Al Al21 1 0.16212753 0.83787247 0.92821892 1.0 Al Al22 1 0.55980629 0.12382579 0.25000000 1.0 Al Al23 1 0.44019371 0.87617421 0.75000000 1.0 Al Al24 1 0.87617421 0.44019371 0.25000000 1.0 Al Al25 1 0.12382579 0.55980629 0.75000000 1.0 Al Al26 1 0.56075798 0.43924202 0.25000000 1.0 Al Al27 1 0.43924202 0.56075798 0.75000000 1.0 Al Al28 1 0.00063620 0.99936380 0.25000000 1.0 Al Al29 1 0.99936380 0.00063620 0.75000000 1.0 Ir Ir30 1 0.50000000 0.50000000 0.00000000 1.0 Ir Ir31 1 0.50000000 0.50000000 0.50000000 1.0 Os Os32 1 0.50000000 0.00000000 0.00000000 1.0 Os Os33 1 0.00000000 0.50000000 0.00000000 1.0 Os Os34 1 0.50000000 0.00000000 0.50000000 1.0 Os Os35 1 0.00000000 0.50000000 0.50000000 1.0 Os Os36 1 0.00000000 0.00000000 0.00000000 1.0 Os Os37 1 0.00000000 0.00000000 0.50000000 1.0