data_[La4Tb8Pr20Th4]
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
  Pr  1.1300  1.8500  1.0600
  Th  1.3000  1.8000  1.0800
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [5.7927]
_cell_length_b [20.5501]
_cell_length_c [10.6928]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [LaTb2Pr5Th]
_chemical_formula_sum '[La4 Tb8 Pr20 Th4]'
_cell_volume [1272.8898]
_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  0.1131  0.7353  1
  Tb  Tb1  4  0.0000  0.1160  0.3185  1
  La  La2  4  0.0000  0.4134  0.4472  1
  Pr  Pr3  4  0.0000  0.0156  0.0243  1
  Pr  Pr4  4  0.0000  0.2775  0.3162  1
  Pr  Pr5  4  0.0000  0.2917  0.7021  1
  Pr  Pr6  4  0.0000  0.3847  0.0265  1
  Pr  Pr7  4  0.0000  0.4783  0.7407  1
  Th  Th8  4  0.0000  0.1983  0.0131  1
]