data_[Tb4Pr16In4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Pr  1.1300  1.8500  1.0600
  In  1.7800  1.5500  0.9400
]
_symmetry_space_group_name_H-M [I4_1md]
_cell_length_a [11.7941]
_cell_length_b [11.7941]
_cell_length_c [6.8619]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [109]
_chemical_formula_structural [TbPr4In]
_chemical_formula_sum '[Tb4 Pr16 In4]'
_cell_volume [954.4914]
_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
[
  Tb  Tb0  4  0.0000  0.0000  0.7267  1
  Pr  Pr1  8  0.0000  0.2609  0.2630  1
  Pr  Pr2  8  0.0000  0.2701  0.7583  1
  In  In3  4  0.0000  0.0000  0.2307  1
]