data_[Li2La1Al1F8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  La  1.1000  1.9500  1.1720
  Al  1.6100  1.2500  0.6750
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [4.5234]
_cell_length_b [4.7989]
_cell_length_c [6.9554]
_cell_angle_alpha [84.7084]
_cell_angle_beta [89.1481]
_cell_angle_gamma [87.5869]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Li2LaAlF8]
_chemical_formula_sum '[Li2 La1 Al1 F8]'
_cell_volume [150.1956]
_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  2  0.4710  0.4700  0.1886  1.0
  La  La1  1  0.0000  0.0000  0.5000  1.0
  Al  Al2  1  0.0000  0.0000  0.0000  1.0
  F  F3  2  0.1786  0.7882  0.2085  1.0
  F  F4  2  0.1874  0.8083  0.8121  1.0
  F  F5  2  0.2850  0.2577  0.9910  1.0
  F  F6  2  0.3791  0.2838  0.4443  1.0
]