data_[La16Pr10Pb2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Pr  1.1300  1.8500  1.0600
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [C2]
_cell_length_a [16.0635]
_cell_length_b [8.5650]
_cell_length_c [8.8087]
_cell_angle_alpha [90.0000]
_cell_angle_beta [122.7540]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [5]
_chemical_formula_structural [La8Pr5Pb]
_chemical_formula_sum '[La16 Pr10 Pb2]'
_cell_volume [1019.2384]
_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
[
  La  La0  4  0.1194  0.4771  0.2024  1
  La  La1  4  0.1683  0.2246  0.5829  1
  La  La2  4  0.1815  0.7299  0.9280  1
  La  La3  4  0.1988  0.0523  0.2735  1
  Pr  Pr4  4  0.0506  0.1513  0.8200  1
  Pr  Pr5  4  0.1013  0.8311  0.4729  1
  Pr  Pr6  2  0.0000  0.4948  0.5000  1
  Pb  Pb7  2  0.0000  0.8227  0.0000  1
]