data_[La16Tl8Ag24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Tl  1.6200  1.9000  1.3325
  Ag  1.9300  1.6000  1.0867
]
_symmetry_space_group_name_H-M [Fmmm]
_cell_length_a [7.1047]
_cell_length_b [9.9893]
_cell_length_c [17.3333]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [69]
_chemical_formula_structural [La2TlAg3]
_chemical_formula_sum '[La16 Tl8 Ag24]'
_cell_volume [1230.1557]
_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
[
  La  La0  8  0.2433  0.0000  0.0000  1
  La  La1  8  0.2500  0.2500  0.2500  1
  Tl  Tl2  8  0.0000  0.0000  0.3337  1
  Ag  Ag3  16  0.0000  0.2471  0.0819  1
  Ag  Ag4  8  0.0000  0.0000  0.1646  1
]