data_[Ho2Hf2F14]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ho  1.2300  1.7500  1.0410
  Hf  1.3000  1.5500  0.8500
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P2_1]
_cell_length_a [6.0357]
_cell_length_b [5.7308]
_cell_length_c [8.2552]
_cell_angle_alpha [90.0000]
_cell_angle_beta [102.7780]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [4]
_chemical_formula_structural [HoHfF7]
_chemical_formula_sum '[Ho2 Hf2 F14]'
_cell_volume [278.4707]
_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  0.3445  0.1981  0.3147  1.0
  Hf  Hf1  2  0.1890  0.2083  0.7760  1.0
  F  F2  2  0.0442  0.4504  0.2413  1.0
  F  F3  2  0.0714  0.9302  0.2295  1.0
  F  F4  2  0.1370  0.2058  0.5273  1.0
  F  F5  2  0.2457  0.1985  0.0239  1.0
  F  F6  2  0.3825  0.4975  0.7828  1.0
  F  F7  2  0.4543  0.9926  0.7887  1.0
  F  F8  2  0.4566  0.8949  0.4783  1.0
]