data_[Li1In2F8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  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 [3.6907]
_cell_length_b [5.9081]
_cell_length_c [7.2840]
_cell_angle_alpha [80.3515]
_cell_angle_beta [88.3907]
_cell_angle_gamma [77.8237]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [LiIn2F8]
_chemical_formula_sum '[Li1 In2 F8]'
_cell_volume [153.0514]
_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
[
  Li  Li0  1  0.5000  0.0000  0.0000  1
  In  In1  2  0.2478  0.4793  0.2785  1
  F  F2  2  0.1097  0.8353  0.1519  1
  F  F3  2  0.2011  0.6392  0.5303  1
  F  F4  2  0.2593  0.4781  0.8763  1
  F  F5  2  0.4147  0.1399  0.2293  1
]