data_[Na4Li4Sb8S16]
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
  Sb  2.0500  1.4500  0.8300
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [Fmm2]
_cell_length_a [7.9026]
_cell_length_b [10.6482]
_cell_length_c [8.2678]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [42]
_chemical_formula_structural [NaLi(SbS2)2]
_chemical_formula_sum '[Na4 Li4 Sb8 S16]'
_cell_volume [695.7281]
_cell_formula_units_Z [4]
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  0.0000  0.9407  1.0
  Li  Li1  4  0.0000  0.0000  0.4684  1.0
  Sb  Sb2  8  0.2500  0.2500  0.2050  1.0
  S  S3  8  0.0000  0.2361  0.4126  1.0
  S  S4  8  0.2406  0.0000  0.6777  1.0
]