data_[Pr2Tl2Sn2Cl12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Tl  1.6200  1.9000  1.3325
  Sn  1.9600  1.4500  0.8300
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P4_2nm]
_cell_length_a [6.9332]
_cell_length_b [6.9332]
_cell_length_c [13.2648]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [102]
_chemical_formula_structural [PrTlSnCl6]
_chemical_formula_sum '[Pr2 Tl2 Sn2 Cl12]'
_cell_volume [637.6252]
_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  2  0.0000  0.0000  0.3318  1.0
  Tl  Tl1  2  0.0000  0.0000  0.9983  1.0
  Sn  Sn2  2  0.0000  0.0000  0.6661  1.0
  Cl  Cl3  4  0.1772  0.8228  0.4976  1.0
  Cl  Cl4  4  0.2059  0.7941  0.1870  1.0
  Cl  Cl5  4  0.2172  0.7828  0.8173  1.0
]