data_[Cs2In2F6]
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
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [5.4990]
_cell_length_b [5.5318]
_cell_length_c [8.5106]
_cell_angle_alpha [98.4542]
_cell_angle_beta [105.6275]
_cell_angle_gamma [107.6849]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [CsInF3]
_chemical_formula_sum '[Cs2 In2 F6]'
_cell_volume [230.0263]
_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  0.3089  0.8492  0.1651  1.0
  In  In1  2  0.1226  0.3260  0.4512  1.0
  F  F2  2  0.0817  0.3078  0.1908  1.0
  F  F3  2  0.1092  0.1042  0.6635  1.0
  F  F4  2  0.4894  0.2604  0.4839  1.0
]