# generated using pymatgen data_NdAl10IrOs _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.84747645 _cell_length_b 6.83701187 _cell_length_c 9.13848978 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 97.21029354 _symmetry_Int_Tables_number 1 _chemical_formula_structural NdAl10IrOs _chemical_formula_sum 'Nd2 Al20 Ir2 Os2' _cell_volume 424.44686755 _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 Nd Nd0 1 0.86925295 0.12444551 0.75000000 1.0 Nd Nd1 1 0.13074705 0.87555449 0.25000000 1.0 Al Al2 1 0.62034489 0.37610754 0.54872816 1.0 Al Al3 1 0.37965511 0.62389246 0.45127184 1.0 Al Al4 1 0.37965511 0.62389246 0.04872816 1.0 Al Al5 1 0.62034489 0.37610754 0.95127184 1.0 Al Al6 1 0.22429863 0.22291442 0.49914548 1.0 Al Al7 1 0.77570137 0.77708558 0.50085452 1.0 Al Al8 1 0.77570137 0.77708558 0.99914548 1.0 Al Al9 1 0.22429863 0.22291442 0.00085452 1.0 Al Al10 1 0.84100626 0.15830807 0.10311905 1.0 Al Al11 1 0.15899374 0.84169193 0.89688095 1.0 Al Al12 1 0.15899374 0.84169193 0.60311905 1.0 Al Al13 1 0.84100626 0.15830807 0.39688095 1.0 Al Al14 1 0.85473401 0.59055617 0.75000000 1.0 Al Al15 1 0.14526599 0.40944383 0.25000000 1.0 Al Al16 1 0.40741981 0.14219230 0.75000000 1.0 Al Al17 1 0.59258019 0.85780770 0.25000000 1.0 Al Al18 1 0.22139568 0.48264627 0.75000000 1.0 Al Al19 1 0.77860432 0.51735373 0.25000000 1.0 Al Al20 1 0.51565166 0.77971756 0.75000000 1.0 Al Al21 1 0.48434834 0.22028244 0.25000000 1.0 Ir Ir22 1 0.00000000 0.50000000 0.50000000 1.0 Ir Ir23 1 0.00000000 0.50000000 0.00000000 1.0 Os Os24 1 0.50000000 0.00000000 0.00000000 1.0 Os Os25 1 0.50000000 0.00000000 0.50000000 1.0