# generated using pymatgen data_Al9Fe2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.11011854 _cell_length_b 6.30829900 _cell_length_c 8.68034517 _cell_angle_alpha 90.00000000 _cell_angle_beta 95.19136994 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Al9Fe2 _chemical_formula_sum 'Al18 Fe4' _cell_volume 333.20674053 _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 Al Al0 1 0.00000000 0.50000000 0.50000000 1.0 Al Al1 1 0.00000000 0.00000000 0.00000000 1.0 Al Al2 1 0.58375700 0.45321400 0.23165900 1.0 Al Al3 1 0.41624300 0.95321400 0.26834100 1.0 Al Al4 1 0.41624300 0.54678600 0.76834100 1.0 Al Al5 1 0.58375700 0.04678600 0.73165900 1.0 Al Al6 1 0.92091200 0.80101800 0.27293100 1.0 Al Al7 1 0.07908800 0.30101800 0.22706900 1.0 Al Al8 1 0.07908800 0.19898200 0.72706900 1.0 Al Al9 1 0.92091200 0.69898200 0.77293100 1.0 Al Al10 1 0.60953500 0.68688300 0.50393500 1.0 Al Al11 1 0.39046500 0.18688300 0.99606500 1.0 Al Al12 1 0.39046500 0.31311700 0.49606500 1.0 Al Al13 1 0.60953500 0.81311700 0.00393500 1.0 Al Al14 1 0.78032300 0.11783400 0.45389000 1.0 Al Al15 1 0.21967700 0.61783400 0.04611000 1.0 Al Al16 1 0.21967700 0.88216600 0.54611000 1.0 Al Al17 1 0.78032300 0.38216600 0.95389000 1.0 Fe Fe18 1 0.73640300 0.11792800 0.16543300 1.0 Fe Fe19 1 0.26359700 0.61792800 0.33456700 1.0 Fe Fe20 1 0.26359700 0.88207200 0.83456700 1.0 Fe Fe21 1 0.73640300 0.38207200 0.66543300 1.0