data_[Cs4Pr4Sn4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Pr  1.1300  1.8500  1.0600
  Sn  1.9600  1.4500  0.8300
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [6.2874]
_cell_length_b [6.2874]
_cell_length_c [14.7373]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.8392]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [CsPrSn]
_chemical_formula_sum '[Cs4 Pr4 Sn4]'
_cell_volume [582.5310]
_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
[
  Cs  Cs0  4  0.2386  0.0000  0.6702  1
  Pr  Pr1  4  0.2470  0.0000  0.9199  1
  Sn  Sn2  4  0.2447  0.5000  0.8570  1
]