data_[Ba2Y2Ag2S6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Y  1.2200  1.8000  1.0400
  Ag  1.9300  1.6000  1.0867
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [8.3705]
_cell_length_b [4.1202]
_cell_length_c [9.2344]
_cell_angle_alpha [90.0000]
_cell_angle_beta [106.0448]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [BaYAgS3]
_chemical_formula_sum '[Ba2 Y2 Ag2 S6]'
_cell_volume [306.0681]
_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
[
  Ba  Ba0  2  0.2892  0.7500  0.2506  1
  Y  Y1  2  0.1782  0.2500  0.6569  1
  Ag  Ag2  2  0.4079  0.7500  0.9062  1
  S  S3  2  0.0485  0.2500  0.3484  1
  S  S4  2  0.2499  0.2500  0.9693  1
  S  S5  2  0.3935  0.7500  0.6279  1
]