# generated using pymatgen data_Yb3Al9Si3Ir4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.62648557 _cell_length_b 8.62648530 _cell_length_c 9.44051277 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.83646078 _symmetry_Int_Tables_number 1 _chemical_formula_structural Yb3Al9Si3Ir4 _chemical_formula_sum 'Yb6 Al18 Si6 Ir8' _cell_volume 609.40685295 _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 0.80760878 0.19239122 0.75000000 1.0 Yb Yb1 1 0.19239122 0.80760878 0.25000000 1.0 Yb Yb2 1 0.38816820 0.19755141 0.75000000 1.0 Yb Yb3 1 0.61183180 0.80244859 0.25000000 1.0 Yb Yb4 1 0.80244859 0.61183180 0.75000000 1.0 Yb Yb5 1 0.19755141 0.38816820 0.25000000 1.0 Al Al6 1 0.83500555 0.16499445 0.41963563 1.0 Al Al7 1 0.16499445 0.83500555 0.58036437 1.0 Al Al8 1 0.32978362 0.16411997 0.42190319 1.0 Al Al9 1 0.16499445 0.83500555 0.91963563 1.0 Al Al10 1 0.67021638 0.83588003 0.57809681 1.0 Al Al11 1 0.83500555 0.16499445 0.08036437 1.0 Al Al12 1 0.83588003 0.67021638 0.42190319 1.0 Al Al13 1 0.67021638 0.83588003 0.92190319 1.0 Al Al14 1 0.16411997 0.32978362 0.57809681 1.0 Al Al15 1 0.32978362 0.16411997 0.07809681 1.0 Al Al16 1 0.16411997 0.32978362 0.92190319 1.0 Al Al17 1 0.83588003 0.67021638 0.07809681 1.0 Al Al18 1 0.12700903 0.56090512 0.75000000 1.0 Al Al19 1 0.87299097 0.43909488 0.25000000 1.0 Al Al20 1 0.43909488 0.87299097 0.75000000 1.0 Al Al21 1 0.56090512 0.12700903 0.25000000 1.0 Al Al22 1 0.00081019 0.99918981 0.75000000 1.0 Al Al23 1 0.99918981 0.00081019 0.25000000 1.0 Si Si24 1 0.66831473 0.33168527 0.95682563 1.0 Si Si25 1 0.33168527 0.66831473 0.04317437 1.0 Si Si26 1 0.33168527 0.66831473 0.45682563 1.0 Si Si27 1 0.66831473 0.33168527 0.54317437 1.0 Si Si28 1 0.43495588 0.56504412 0.75000000 1.0 Si Si29 1 0.56504412 0.43495588 0.25000000 1.0 Ir Ir30 1 0.50000000 0.50000000 0.00000000 1.0 Ir Ir31 1 0.00000000 0.50000000 0.00000000 1.0 Ir Ir32 1 0.50000000 0.50000000 0.50000000 1.0 Ir Ir33 1 0.50000000 0.00000000 0.00000000 1.0 Ir Ir34 1 0.00000000 0.50000000 0.50000000 1.0 Ir Ir35 1 0.50000000 0.00000000 0.50000000 1.0 Ir Ir36 1 0.00000000 0.00000000 0.00000000 1.0 Ir Ir37 1 0.00000000 0.00000000 0.50000000 1.0