data_[Pr20Ga8Sn4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Ga  1.8100  1.3000  0.7600
  Sn  1.9600  1.4500  0.8300
]
_symmetry_space_group_name_H-M [I4/mcm]
_cell_length_a [8.1698]
_cell_length_b [8.1698]
_cell_length_c [14.4228]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [140]
_chemical_formula_structural [Pr5Ga2Sn]
_chemical_formula_sum '[Pr20 Ga8 Sn4]'
_cell_volume [962.6663]
_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
[
  Pr  Pr0  16  0.1702  0.3298  0.3546  1.0
  Pr  Pr1  4  0.0000  0.0000  0.0000  1.0
  Ga  Ga2  8  0.1208  0.6208  0.5000  1.0
  Sn  Sn3  4  0.0000  0.0000  0.2500  1.0
]