data_[Na4Li6W2S12]
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
  W  2.3600  1.3500  0.7667
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.0275]
_cell_length_b [11.7447]
_cell_length_c [6.0507]
_cell_angle_alpha [90.0000]
_cell_angle_beta [116.3209]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Na2Li3WS6]
_chemical_formula_sum '[Na4 Li6 W2 S12]'
_cell_volume [447.6245]
_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  0.0000  0.3330  0.0000  1
  Li  Li1  4  0.0000  0.2000  0.5000  1
  Li  Li2  2  0.0000  0.5000  0.5000  1
  W  W3  2  0.0000  0.0000  0.0000  1
  S  S4  8  0.2455  0.1454  0.2418  1
  S  S5  4  0.1343  0.0000  0.6902  1
]