data_[Cs3Na2Pb1F8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Na  0.9300  1.8000  1.1600
  Pb  2.3300  1.8000  1.1225
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P-3m1]
_cell_length_a [6.5552]
_cell_length_b [6.5552]
_cell_length_c [8.6168]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [164]
_chemical_formula_structural [Cs3Na2PbF8]
_chemical_formula_sum '[Cs3 Na2 Pb1 F8]'
_cell_volume [320.6610]
_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  0.3333  0.6667  0.3423  1.0
  Cs  Cs1  1  0.0000  0.0000  0.0000  1.0
  Na  Na2  2  0.3333  0.6667  0.7892  1.0
  Pb  Pb3  1  0.0000  0.0000  0.5000  1.0
  F  F4  6  0.1609  0.3218  0.6578  1.0
  F  F5  2  0.3333  0.6667  0.0329  1.0
]