data_[Li2La1Cr1F8]
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
  Cr  1.6600  1.4000  0.9400
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [4.4975]
_cell_length_b [4.9139]
_cell_length_c [7.1474]
_cell_angle_alpha [84.4780]
_cell_angle_beta [89.5040]
_cell_angle_gamma [87.4517]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Li2LaCrF8]
_chemical_formula_sum '[Li2 La1 Cr1 F8]'
_cell_volume [157.0689]
_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  0.4690  0.4679  0.1924  1
  La  La1  1  0.0000  0.0000  0.5000  1
  Cr  Cr2  1  0.0000  0.0000  0.0000  1
  F  F3  2  0.1733  0.7777  0.2220  1
  F  F4  2  0.1783  0.7953  0.8019  1
  F  F5  2  0.3079  0.2658  0.9901  1
  F  F6  2  0.3860  0.2752  0.4437  1
]