data_[La20Tb4In8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Tb  1.1000  1.7500  0.9815
  In  1.7800  1.5500  0.9400
]
_symmetry_space_group_name_H-M [Cmcm]
_cell_length_a [5.2787]
_cell_length_b [12.3245]
_cell_length_c [16.5589]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [63]
_chemical_formula_structural [La5TbIn2]
_chemical_formula_sum '[La20 Tb4 In8]'
_cell_volume [1077.2879]
_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  0.0000  0.0347  0.1044  1
  La  La1  8  0.0000  0.3546  0.0268  1
  Tb  Tb2  4  0.0000  0.2566  0.2500  1
  La  La3  4  0.0000  0.4678  0.7500  1
  In  In4  8  0.0000  0.2269  0.6495  1
]