data_[Cs8In4Sn4F20]
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
  Sn  1.9600  1.4500  0.8300
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [3.8169]
_cell_length_b [19.2037]
_cell_length_c [11.7752]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [Cs2InSnF5]
_chemical_formula_sum '[Cs8 In4 Sn4 F20]'
_cell_volume [863.0978]
_cell_formula_units_Z [4]
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  0.1185  0.3064  1.0
  Cs  Cs1  4  0.0000  0.1254  0.7000  1.0
  In  In2  4  0.0000  0.4576  0.4949  1.0
  Sn  Sn3  4  0.0000  0.2124  0.0010  1.0
  F  F4  4  0.0000  0.0306  0.5092  1.0
  F  F5  4  0.0000  0.2755  0.6252  1.0
  F  F6  4  0.0000  0.2757  0.3753  1.0
  F  F7  4  0.0000  0.3212  0.0005  1.0
  F  F8  4  0.0000  0.4859  0.3114  1.0
]