data_[Cs2Zn2F6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Zn  1.6500  1.3500  0.8800
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [5.7474]
_cell_length_b [5.8068]
_cell_length_c [6.1577]
_cell_angle_alpha [90.0000]
_cell_angle_beta [101.8153]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [CsZnF3]
_chemical_formula_sum '[Cs2 Zn2 F6]'
_cell_volume [201.1513]
_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  0.3320  0.7500  0.6454  1.0
  Zn  Zn1  2  0.0475  0.2500  0.9224  1.0
  F  F2  4  0.2137  0.5037  0.1226  1.0
  F  F3  2  0.1717  0.2500  0.6557  1.0
]