data_[Li4Cd2Si2S8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Cd  1.6900  1.5500  1.0900
  Si  1.9000  1.1000  0.5400
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [Pmn2_1]
_cell_length_a [7.6909]
_cell_length_b [6.8608]
_cell_length_c [6.4026]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [31]
_chemical_formula_structural [Li2CdSiS4]
_chemical_formula_sum '[Li4 Cd2 Si2 S8]'
_cell_volume [337.8401]
_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
[
  Li  Li0  4  0.2459  0.1711  0.0008  1.0
  Cd  Cd1  2  0.0000  0.3559  0.4990  1.0
  Si  Si2  2  0.0000  0.6765  0.9996  1.0
  S  S3  4  0.2229  0.8299  0.8821  1.0
  S  S4  2  0.0000  0.3779  0.9017  1.0
  S  S5  2  0.0000  0.6944  0.3339  1.0
]