data_[Cs1In2Ga1F6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  In  1.7800  1.5500  0.9400
  Ga  1.8100  1.3000  0.7600
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [6.0997]
_cell_length_b [6.1891]
_cell_length_c [6.6608]
_cell_angle_alpha [69.0698]
_cell_angle_beta [69.1822]
_cell_angle_gamma [67.5358]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [CsIn2GaF6]
_chemical_formula_sum '[Cs1 In2 Ga1 F6]'
_cell_volume [209.9490]
_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  1  0.0000  0.0000  0.0000  1
  In  In1  2  0.2609  0.2663  0.2988  1
  Ga  Ga2  1  0.5000  0.5000  0.5000  1
  F  F3  2  0.1986  0.6558  0.4003  1
  F  F4  2  0.3553  0.6103  0.7662  1
  F  F5  2  0.3883  0.2106  0.6325  1
]