data_[Cs4Li2Ga2F12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Li  0.9800  1.4500  0.9000
  Ga  1.8100  1.3000  0.7600
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [Pmmn]
_cell_length_a [6.3509]
_cell_length_b [7.8738]
_cell_length_c [6.8584]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [59]
_chemical_formula_structural [Cs2LiGaF6]
_chemical_formula_sum '[Cs4 Li2 Ga2 F12]'
_cell_volume [342.9621]
_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  0.0000  0.2376  0.2153  1.0
  Li  Li1  2  0.0000  0.5000  0.6214  1.0
  Ga  Ga2  2  0.0000  0.0000  0.7121  1.0
  F  F3  4  0.0000  0.2513  0.7056  1.0
  F  F4  4  0.2073  0.0000  0.9145  1.0
  F  F5  4  0.2246  0.0000  0.5169  1.0
]