data_[Li2Ce4Ag6S12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Ce  1.1200  1.8500  1.0800
  Ag  1.9300  1.6000  1.0867
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [16.1209]
_cell_length_b [4.1448]
_cell_length_c [7.7057]
_cell_angle_alpha [90.0000]
_cell_angle_beta [99.1611]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [LiCe2(AgS2)3]
_chemical_formula_sum '[Li2 Ce4 Ag6 S12]'
_cell_volume [508.3160]
_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  2  0.0000  0.5000  0.0000  1.0
  Ce  Ce1  4  0.1554  0.0000  0.3184  1.0
  Ag  Ag2  4  0.1699  0.0000  0.8301  1.0
  Ag  Ag3  2  0.0000  0.5000  0.5000  1.0
  S  S4  4  0.0071  0.0000  0.7570  1.0
  S  S5  4  0.1670  0.5000  0.0902  1.0
  S  S6  4  0.1691  0.5000  0.5639  1.0
]