data_[Cs1Li1La2Cl8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Li  0.9800  1.4500  0.9000
  La  1.1000  1.9500  1.1720
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [6.9392]
_cell_length_b [8.9723]
_cell_length_c [6.9900]
_cell_angle_alpha [90.0000]
_cell_angle_beta [98.2126]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [CsLiLa2Cl8]
_chemical_formula_sum '[Cs1 Li1 La2 Cl8]'
_cell_volume [430.7379]
_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
[
  Cs  Cs0  1  0.0000  0.5000  0.0000  1.0
  Li  Li1  1  0.0000  0.0000  0.0000  1.0
  La  La2  2  0.5000  0.2382  0.5000  1.0
  Cl  Cl3  4  0.2248  0.1977  0.1823  1.0
  Cl  Cl4  2  0.3053  0.0000  0.6564  1.0
  Cl  Cl5  2  0.3132  0.5000  0.6355  1.0
]