data_[Tb8Pr6In2]
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 [Pmn2_1]
_cell_length_a [11.3994]
_cell_length_b [7.1764]
_cell_length_c [6.2895]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [31]
_chemical_formula_structural [Tb4Pr3In]
_chemical_formula_sum '[Tb8 Pr6 In2]'
_cell_volume [514.5261]
_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  4  0.2378  0.1247  0.1398  1
  Tb  Tb1  2  0.0000  0.1290  0.4839  1
  Tb  Tb2  2  0.0000  0.8804  0.9606  1
  Pr  Pr3  4  0.2386  0.6164  0.1561  1
  Pr  Pr4  2  0.0000  0.6276  0.5015  1
  In  In5  2  0.0000  0.3623  0.9775  1
]