data_[Ho2Cd4F12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ho  1.2300  1.7500  1.0410
  Cd  1.6900  1.5500  1.0900
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [11.8275]
_cell_length_b [3.8624]
_cell_length_c [7.9524]
_cell_angle_alpha [90.0000]
_cell_angle_beta [125.3861]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [HoCd2F6]
_chemical_formula_sum '[Ho2 Cd4 F12]'
_cell_volume [296.1782]
_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
[
  Ho  Ho0  2  0.0000  0.0000  0.5000  1
  Cd  Cd1  4  0.1556  0.0000  0.1005  1
  F  F2  4  0.0419  0.0000  0.2626  1
  F  F3  4  0.1255  0.5000  0.5735  1
  F  F4  4  0.2189  0.0000  0.8417  1
]