data_[Cs4Pr2In2I12]
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
  In  1.7800  1.5500  0.9400
  I  2.6600  1.4000  1.2733
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [8.7916]
_cell_length_b [9.3307]
_cell_length_c [15.4385]
_cell_angle_alpha [90.0000]
_cell_angle_beta [124.4363]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Cs2PrInI6]
_chemical_formula_sum '[Cs4 Pr2 In2 I12]'
_cell_volume [1044.5047]
_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
[
  Cs  Cs0  4  0.2762  0.5765  0.7499  1.0
  Pr  Pr1  2  0.0000  0.0000  0.5000  1.0
  In  In2  2  0.5000  0.0000  0.0000  1.0
  I  I3  4  0.1483  0.5196  0.2397  1.0
  I  I4  4  0.2282  0.2154  0.0468  1.0
  I  I5  4  0.3374  0.6854  0.0455  1.0
]