data_[Cs4Ba2Li2F12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Ba  0.8900  2.1500  1.4900
  Li  0.9800  1.4500  0.9000
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [6.2191]
_cell_length_b [6.2157]
_cell_length_c [10.7714]
_cell_angle_alpha [90.0000]
_cell_angle_beta [125.3208]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Cs2BaLiF6]
_chemical_formula_sum '[Cs4 Ba2 Li2 F12]'
_cell_volume [339.7380]
_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  0.2499  0.5031  0.2498  1
  Ba  Ba1  2  0.5000  0.0000  0.5000  1
  Li  Li2  2  0.0000  0.0000  0.0000  1
  F  F3  4  0.2110  0.0082  0.2227  1
  F  F4  4  0.2216  0.2273  0.0036  1
  F  F5  4  0.2353  0.7181  0.5081  1
]