# generated using pymatgen data_Yb6Nb4Al12Ir7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.97801592 _cell_length_b 8.97801691 _cell_length_c 8.97801697 _cell_angle_alpha 59.99999975 _cell_angle_beta 59.99999612 _cell_angle_gamma 60.00000731 _symmetry_Int_Tables_number 1 _chemical_formula_structural Yb6Nb4Al12Ir7 _chemical_formula_sum 'Yb6 Nb4 Al12 Ir7' _cell_volume 511.71273407 _cell_formula_units_Z 1 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 0.70199727 0.70199727 0.29800273 1.0 Yb Yb1 1 0.29800273 0.70199727 0.29800273 1.0 Yb Yb2 1 0.70199727 0.29800273 0.29800273 1.0 Yb Yb3 1 0.29800273 0.29800273 0.70199727 1.0 Yb Yb4 1 0.70199727 0.29800273 0.70199727 1.0 Yb Yb5 1 0.29800273 0.70199727 0.70199727 1.0 Nb Nb6 1 0.88037603 0.88037603 0.35887191 1.0 Nb Nb7 1 0.88037603 0.35887191 0.88037603 1.0 Nb Nb8 1 0.35887191 0.88037603 0.88037603 1.0 Nb Nb9 1 0.88037603 0.88037603 0.88037603 1.0 Al Al10 1 0.12161918 0.12161918 0.63514246 1.0 Al Al11 1 0.12161918 0.63514246 0.12161918 1.0 Al Al12 1 0.63514246 0.12161918 0.12161918 1.0 Al Al13 1 0.12161918 0.12161918 0.12161918 1.0 Al Al14 1 0.67174718 0.67174718 0.98475647 1.0 Al Al15 1 0.67174718 0.98475647 0.67174718 1.0 Al Al16 1 0.98475647 0.67174718 0.67174718 1.0 Al Al17 1 0.67174718 0.67174718 0.67174718 1.0 Al Al18 1 0.32640287 0.32640287 0.02079338 1.0 Al Al19 1 0.32640287 0.02079338 0.32640287 1.0 Al Al20 1 0.02079338 0.32640287 0.32640287 1.0 Al Al21 1 0.32640287 0.32640287 0.32640287 1.0 Ir Ir22 1 0.00000000 0.00000000 0.00000000 1.0 Ir Ir23 1 0.99847711 0.99847711 0.50152289 1.0 Ir Ir24 1 0.50152289 0.99847711 0.50152289 1.0 Ir Ir25 1 0.99847711 0.50152289 0.50152289 1.0 Ir Ir26 1 0.50152289 0.50152289 0.99847711 1.0 Ir Ir27 1 0.99847711 0.50152289 0.99847711 1.0 Ir Ir28 1 0.50152289 0.99847711 0.99847711 1.0