data_[Cs2Na4V2F12]
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
  V  1.6300  1.3500  0.7775
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [6.3678]
_cell_length_b [6.1966]
_cell_length_c [10.6729]
_cell_angle_alpha [90.0000]
_cell_angle_beta [126.3921]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [CsNa2VF6]
_chemical_formula_sum '[Cs2 Na4 V2 F12]'
_cell_volume [339.0087]
_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  2  0.5000  0.0000  0.0000  1.0
  Na  Na1  4  0.2376  0.0421  0.2116  1.0
  V  V2  2  0.0000  0.0000  0.5000  1.0
  F  F3  4  0.0741  0.0622  0.3485  1.0
  F  F4  4  0.1185  0.7014  0.5199  1.0
  F  F5  4  0.3590  0.1132  0.6720  1.0
]