data_[Na2Li2Ce2S6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  Li  0.9800  1.4500  0.9000
  Ce  1.1200  1.8500  1.0800
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [7.0478]
_cell_length_b [4.1328]
_cell_length_c [9.8488]
_cell_angle_alpha [90.0000]
_cell_angle_beta [97.0412]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [NaLiCeS3]
_chemical_formula_sum '[Na2 Li2 Ce2 S6]'
_cell_volume [284.7028]
_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  2  0.3862  0.2500  0.3200  1.0
  Li  Li1  2  0.3318  0.7500  0.9481  1.0
  Ce  Ce2  2  0.1164  0.2500  0.6807  1.0
  S  S3  2  0.0046  0.2500  0.1782  1.0
  S  S4  2  0.2239  0.7500  0.5078  1.0
  S  S5  2  0.4506  0.2500  0.8332  1.0
]