data_[Rb2In2S6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rb  0.8200  2.3500  1.6600
  In  1.7800  1.5500  0.9400
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [6.6604]
_cell_length_b [6.7873]
_cell_length_c [8.2067]
_cell_angle_alpha [69.5589]
_cell_angle_beta [86.5232]
_cell_angle_gamma [71.0929]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [RbInS3]
_chemical_formula_sum '[Rb2 In2 S6]'
_cell_volume [328.2978]
_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  0.3851  0.8399  0.8225  1.0
  In  In1  2  0.2449  0.5225  0.4923  1.0
  S  S2  2  0.0597  0.3506  0.0890  1.0
  S  S3  2  0.1043  0.2418  0.4434  1.0
  S  S4  2  0.4750  0.6626  0.2621  1.0
]