data_[Li24Tl8Au8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Tl  1.6200  1.9000  1.3325
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [Cmce]
_cell_length_a [11.7312]
_cell_length_b [10.0561]
_cell_length_c [6.3376]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [64]
_chemical_formula_structural [Li3TlAu]
_chemical_formula_sum '[Li24 Tl8 Au8]'
_cell_volume [747.6423]
_cell_formula_units_Z [8]
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  16  0.1446  0.2278  0.6063  1.0
  Li  Li1  8  0.0000  0.0971  0.3242  1.0
  Tl  Tl2  8  0.2500  0.0240  0.2500  1.0
  Au  Au3  8  0.0000  0.1278  0.8870  1.0
]