data_[Cd4F3]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cd  1.6900  1.5500  1.0900
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [Pm]
_cell_length_a [5.8602]
_cell_length_b [3.1872]
_cell_length_c [20.0016]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [6]
_chemical_formula_structural [Cd4F3]
_chemical_formula_sum '[Cd4 F3]'
_cell_volume [373.5800]
_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
[
  Cd  Cd0  1  0.0724  0.0000  0.5637  1
  Cd  Cd1  1  0.4040  0.0000  0.4126  1
  Cd  Cd2  1  0.4698  0.5000  0.6003  1
  Cd  Cd3  1  0.9796  0.5000  0.4354  1
  F  F4  1  0.5952  0.5000  0.4866  1
  F  F5  1  0.7399  0.0000  0.6257  1
  F  F6  1  0.7698  0.0000  0.3756  1
]