data_[Tl4Ga2F16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tl  1.6200  1.9000  1.3325
  Ga  1.8100  1.3000  0.7600
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [9.5554]
_cell_length_b [7.3349]
_cell_length_c [4.6695]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.0965]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Tl2GaF8]
_chemical_formula_sum '[Tl4 Ga2 F16]'
_cell_volume [309.2674]
_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
[
  Tl  Tl0  4  0.1682  0.5000  0.3634  1.0
  Ga  Ga1  2  0.0000  0.0000  0.0000  1.0
  F  F2  8  0.1344  0.1820  0.2573  1.0
  F  F3  4  0.0866  0.5000  0.7988  1.0
  F  F4  4  0.1219  0.0000  0.7590  1.0
]