data_[Ba4Ag4Sn8S24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Ag  1.9300  1.6000  1.0867
  Sn  1.9600  1.4500  0.8300
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [14.3235]
_cell_length_b [11.8599]
_cell_length_c [6.9062]
_cell_angle_alpha [90.0000]
_cell_angle_beta [112.6169]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [BaAg(SnS3)2]
_chemical_formula_sum '[Ba4 Ag4 Sn8 S24]'
_cell_volume [1082.9664]
_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
[
  Ba  Ba0  4  0.0000  0.3088  0.7500  1.0
  Ag  Ag1  4  0.0000  0.1027  0.2500  1.0
  Sn  Sn2  8  0.2331  0.3939  0.3929  1.0
  S  S3  8  0.1010  0.0797  0.6237  1.0
  S  S4  8  0.1296  0.4865  0.5576  1.0
  S  S5  8  0.1609  0.2147  0.2307  1.0
]