data_[Li4Au4F16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Au  2.5400  1.3500  1.0700
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [11.0035]
_cell_length_b [6.6787]
_cell_length_c [4.9753]
_cell_angle_alpha [90.0000]
_cell_angle_beta [113.9994]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [LiAuF4]
_chemical_formula_sum '[Li4 Au4 F16]'
_cell_volume [334.0214]
_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
[
  Li  Li0  4  0.0000  0.3457  0.7500  1.0
  Au  Au1  4  0.2500  0.2500  0.5000  1.0
  F  F2  8  0.1112  0.4004  0.1833  1.0
  F  F3  8  0.1247  0.1650  0.6697  1.0
]