data_[La12Ho16Tl8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Ho  1.2300  1.7500  1.0410
  Tl  1.6200  1.9000  1.3325
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [14.2893]
_cell_length_b [12.6620]
_cell_length_c [6.5219]
_cell_angle_alpha [90.0000]
_cell_angle_beta [100.2967]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [La3(Ho2Tl)2]
_chemical_formula_sum '[La12 Ho16 Tl8]'
_cell_volume [1161.0147]
_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
[
  La  La0  8  0.1030  0.0637  0.0759  1
  La  La1  4  0.0000  0.4698  0.2500  1
  Ho  Ho2  8  0.0846  0.2279  0.5740  1
  Ho  Ho3  8  0.1818  0.3340  0.0931  1
  Tl  Tl4  8  0.2161  0.4129  0.5696  1
]