data_[K2Zr2Ag2S6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Zr  1.3300  1.5500  0.8600
  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 [8.4088]
_cell_length_b [3.8747]
_cell_length_c [9.4459]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.1167]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [KZrAgS3]
_chemical_formula_sum '[K2 Zr2 Ag2 S6]'
_cell_volume [290.7882]
_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
[
  K  K0  2  0.2340  0.7500  0.2647  1.0
  Zr  Zr1  2  0.3163  0.2500  0.8434  1.0
  Ag  Ag2  2  0.0767  0.7500  0.6089  1.0
  S  S3  2  0.1245  0.7500  0.8827  1.0
  S  S4  2  0.2574  0.2500  0.5616  1.0
  S  S5  2  0.4644  0.2500  0.1392  1.0
]