data_[Tb4Pr12Pb12]
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
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [8.5352]
_cell_length_b [10.9744]
_cell_length_c [9.8233]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.5363]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Tb(PrPb)3]
_chemical_formula_sum '[Tb4 Pr12 Pb12]'
_cell_volume [920.0881]
_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  0.2135  0.5000  0.9661  1
  Pr  Pr1  4  0.0000  0.1848  0.5000  1
  Pr  Pr2  4  0.0000  0.2297  0.0000  1
  Pr  Pr3  4  0.0733  0.5000  0.3118  1
  Pb  Pb4  8  0.2395  0.2814  0.7418  1
  Pb  Pb5  4  0.0382  0.0000  0.7658  1
]