# generated using pymatgen data_CsAl2Au3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.61655076 _cell_length_b 7.20723214 _cell_length_c 13.47816416 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural CsAl2Au3 _chemical_formula_sum 'Cs4 Al8 Au12' _cell_volume 545.59318893 _cell_formula_units_Z 4 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 Cs Cs0 1 0.25000000 0.09146512 0.06810632 1.0 Cs Cs1 1 0.25000000 0.40853488 0.56810632 1.0 Cs Cs2 1 0.75000000 0.90853488 0.93189368 1.0 Cs Cs3 1 0.75000000 0.59146512 0.43189368 1.0 Al Al4 1 0.99960256 0.91296048 0.65717182 1.0 Al Al5 1 0.50039744 0.58703952 0.15717182 1.0 Al Al6 1 0.49960256 0.08703952 0.34282818 1.0 Al Al7 1 0.00039744 0.41296048 0.84282818 1.0 Al Al8 1 0.00039744 0.08703952 0.34282818 1.0 Al Al9 1 0.49960256 0.41296048 0.84282818 1.0 Al Al10 1 0.50039744 0.91296048 0.65717182 1.0 Al Al11 1 0.99960256 0.58703952 0.15717182 1.0 Au Au12 1 0.25000000 0.13043147 0.78152282 1.0 Au Au13 1 0.25000000 0.36956853 0.28152282 1.0 Au Au14 1 0.75000000 0.86956853 0.21847718 1.0 Au Au15 1 0.75000000 0.63043147 0.71847718 1.0 Au Au16 1 0.25000000 0.70668906 0.78587284 1.0 Au Au17 1 0.25000000 0.79331094 0.28587284 1.0 Au Au18 1 0.75000000 0.29331094 0.21412716 1.0 Au Au19 1 0.75000000 0.20668906 0.71412716 1.0 Au Au20 1 0.25000000 0.56934525 0.99621128 1.0 Au Au21 1 0.25000000 0.93065475 0.49621128 1.0 Au Au22 1 0.75000000 0.43065475 0.00378872 1.0 Au Au23 1 0.75000000 0.06934525 0.50378872 1.0