data_[Cd1Ge1Cl1F6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cd  1.6900  1.5500  1.0900
  Ge  2.0100  1.2500  0.7700
  Cl  3.1600  1.0000  0.7800
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [4.9930]
_cell_length_b [5.5167]
_cell_length_c [5.9797]
_cell_angle_alpha [69.7664]
_cell_angle_beta [84.8315]
_cell_angle_gamma [82.7971]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [CdGeClF6]
_chemical_formula_sum '[Cd1 Ge1 Cl1 F6]'
_cell_volume [153.1315]
_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  0.5704  0.2722  0.3197  1
  Ge  Ge1  1  0.4754  0.6490  0.6525  1
  Cl  Cl2  1  0.1158  0.1961  0.1587  1
  F  F3  1  0.1694  0.4882  0.7897  1
  F  F4  1  0.2911  0.9625  0.6296  1
  F  F5  1  0.3561  0.6504  0.3679  1
  F  F6  1  0.5983  0.5976  0.9447  1
  F  F7  1  0.6746  0.3421  0.6559  1
  F  F8  1  0.7488  0.8416  0.4815  1
]