data_[Pr16In2Sn10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  In  1.7800  1.5500  0.9400
  Sn  1.9600  1.4500  0.8300
]
_symmetry_space_group_name_H-M [I-4]
_cell_length_a [9.6770]
_cell_length_b [9.6770]
_cell_length_c [9.6939]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [82]
_chemical_formula_structural [Pr8InSn5]
_chemical_formula_sum '[Pr16 In2 Sn10]'
_cell_volume [907.7893]
_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
[
  Pr  Pr0  8  0.0683  0.8231  0.8034  1
  Pr  Pr1  8  0.0732  0.6816  0.4424  1
  In  In2  2  0.0000  0.5000  0.7500  1
  Sn  Sn3  8  0.1256  0.7482  0.1226  1
  Sn  Sn4  2  0.0000  0.0000  0.5000  1
]