data_[Rb2Hf2Ag2S6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rb  0.8200  2.3500  1.6600
  Hf  1.3000  1.5500  0.8500
  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 [8.6232]
_cell_length_b [3.8568]
_cell_length_c [9.7112]
_cell_angle_alpha [90.0000]
_cell_angle_beta [111.2351]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [RbHfAgS3]
_chemical_formula_sum '[Rb2 Hf2 Ag2 S6]'
_cell_volume [301.0458]
_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
[
  Rb  Rb0  2  0.2384  0.7500  0.2680  1.0
  Hf  Hf1  2  0.3182  0.2500  0.8452  1.0
  Ag  Ag2  2  0.0734  0.7500  0.6094  1.0
  S  S3  2  0.1330  0.7500  0.8803  1.0
  S  S4  2  0.2562  0.2500  0.5717  1.0
  S  S5  2  0.4696  0.2500  0.1336  1.0
]