data_[Li16Hg2Au10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Hg  2.0000  1.5000  1.2450
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [I-4]
_cell_length_a [7.6928]
_cell_length_b [7.6928]
_cell_length_c [8.0834]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [82]
_chemical_formula_structural [Li8HgAu5]
_chemical_formula_sum '[Li16 Hg2 Au10]'
_cell_volume [478.3717]
_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
[
  Li  Li0  8  0.0675  0.6721  0.5877  1.0
  Li  Li1  8  0.0955  0.8332  0.2364  1.0
  Hg  Hg2  2  0.0000  0.5000  0.2500  1.0
  Au  Au3  8  0.1227  0.7819  0.9131  1.0
  Au  Au4  2  0.0000  0.0000  0.5000  1.0
]