data_[K6Li3Al9Au36]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Li  0.9800  1.4500  0.9000
  Al  1.6100  1.2500  0.6750
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [8.9486]
_cell_length_b [8.9486]
_cell_length_c [19.2422]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [166]
_chemical_formula_structural [K2Li(AlAu4)3]
_chemical_formula_sum '[K6 Li3 Al9 Au36]'
_cell_volume [1334.4259]
_cell_formula_units_Z [3]
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
[
  K  K0  6  0.0000  0.0000  0.4012  1
  Li  Li1  3  0.0000  0.0000  0.0000  1
  Al  Al2  9  0.0000  0.5000  0.5000  1
  Au  Au3  18  0.0183  0.5092  0.6325  1
  Au  Au4  18  0.0899  0.5449  0.8903  1
]