data_[Cd2As2O4F2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cd  1.6900  1.5500  1.0900
  As  2.1800  1.1500  0.6600
  O  3.4400  0.6000  1.2600
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [5.7803]
_cell_length_b [3.9225]
_cell_length_c [7.2033]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.7865]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [CdAsO2F]
_chemical_formula_sum '[Cd2 As2 O4 F2]'
_cell_volume [155.5156]
_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
[
  Cd  Cd0  2  0.2774  0.7500  0.0430  1.0
  As  As1  2  0.3328  0.7500  0.5742  1.0
  O  O2  2  0.4345  0.2500  0.5606  1.0
  O  O3  2  0.4934  0.2500  0.1702  1.0
  F  F4  2  0.0544  0.2500  0.8648  1.0
]