data_[Cs2K1Pr1F6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  K  0.8200  2.2000  1.5200
  Pr  1.1300  1.8500  1.0600
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [6.5995]
_cell_length_b [6.6222]
_cell_length_c [6.6280]
_cell_angle_alpha [61.2256]
_cell_angle_beta [60.7556]
_cell_angle_gamma [60.1235]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Cs2KPrF6]
_chemical_formula_sum '[Cs2 K1 Pr1 F6]'
_cell_volume [208.0293]
_cell_formula_units_Z [1]
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  2  0.2471  0.2571  0.2428  1
  K  K1  1  0.5000  0.5000  0.5000  1
  Pr  Pr2  1  0.0000  0.0000  0.0000  1
  F  F3  2  0.1994  0.2767  0.7981  1
  F  F4  2  0.2192  0.8419  0.6846  1
  F  F5  2  0.2938  0.7185  0.1815  1
]