data_[Na4La2Cl12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  La  1.1000  1.9500  1.1720
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [14.7573]
_cell_length_b [4.9069]
_cell_length_c [9.1548]
_cell_angle_alpha [90.0000]
_cell_angle_beta [124.9952]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Na2LaCl6]
_chemical_formula_sum '[Na4 La2 Cl12]'
_cell_volume [543.0621]
_cell_formula_units_Z [2]
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  4  0.1733  0.0000  0.1054  1
  La  La1  2  0.0000  0.0000  0.5000  1
  Cl  Cl2  4  0.0356  0.0000  0.2244  1
  Cl  Cl3  4  0.1199  0.5000  0.5214  1
  Cl  Cl4  4  0.2202  0.0000  0.8304  1
]