data_[Na1Hf1In2F8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  Hf  1.3000  1.5500  0.8500
  In  1.7800  1.5500  0.9400
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [5.5043]
_cell_length_b [6.0594]
_cell_length_c [6.6804]
_cell_angle_alpha [88.0363]
_cell_angle_beta [88.6570]
_cell_angle_gamma [86.5668]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [NaHfIn2F8]
_chemical_formula_sum '[Na1 Hf1 In2 F8]'
_cell_volume [222.2272]
_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
[
  Na  Na0  1  0.0000  0.0000  0.5000  1
  Hf  Hf1  1  0.0000  0.0000  0.0000  1
  In  In2  2  0.4945  0.4880  0.7681  1
  F  F3  2  0.1227  0.7928  0.7843  1
  F  F4  2  0.1679  0.8198  0.2238  1
  F  F5  2  0.2916  0.1730  0.9515  1
  F  F6  2  0.3435  0.3312  0.5060  1
]