data_[Tb2Ho10Tl16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Ho  1.2300  1.7500  1.0410
  Tl  1.6200  1.9000  1.3325
]
_symmetry_space_group_name_H-M [I-4]
_cell_length_a [9.2434]
_cell_length_b [9.2434]
_cell_length_c [9.2990]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [82]
_chemical_formula_structural [TbHo5Tl8]
_chemical_formula_sum '[Tb2 Ho10 Tl16]'
_cell_volume [794.5155]
_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
[
  Tb  Tb0  2  0.0000  0.5000  0.7500  1.0
  Ho  Ho1  8  0.1268  0.2475  0.1225  1.0
  Ho  Ho2  2  0.0000  0.0000  0.5000  1.0
  Tl  Tl3  8  0.0808  0.3325  0.4529  1.0
  Tl  Tl4  8  0.0830  0.1672  0.7925  1.0
]