data_[Cs8Te2Br2F2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Te  2.1000  1.4000  1.2933
  Br  2.9600  1.1500  0.8825
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [7.0803]
_cell_length_b [8.3474]
_cell_length_c [10.9664]
_cell_angle_alpha [90.0000]
_cell_angle_beta [101.1353]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [Cs4TeBrF]
_chemical_formula_sum '[Cs8 Te2 Br2 F2]'
_cell_volume [635.9313]
_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  0.2884  0.5110  0.2140  1
  Cs  Cs1  2  0.1811  0.2500  0.5565  1
  Cs  Cs2  2  0.2341  0.7500  0.8671  1
  Te  Te3  2  0.2230  0.2500  0.9105  1
  Br  Br4  2  0.3404  0.7500  0.5305  1
  F  F5  2  0.1145  0.2500  0.2985  1
]