data_[Rb12S2Br4Cl6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rb  0.8200  2.3500  1.6600
  S  2.5800  1.0000  0.8800
  Br  2.9600  1.1500  0.8825
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [8.1960]
_cell_length_b [14.6014]
_cell_length_c [8.5199]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.7117]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Rb6SBr2Cl3]
_chemical_formula_sum '[Rb12 S2 Br4 Cl6]'
_cell_volume [959.8558]
_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  8  0.2476  0.1664  0.2592  1
  Rb  Rb1  4  0.2402  0.0000  0.7333  1
  S  S2  2  0.0000  0.0000  0.0000  1
  Br  Br3  4  0.0000  0.3379  0.0000  1
  Cl  Cl4  4  0.0000  0.1686  0.5000  1
  Cl  Cl5  2  0.0000  0.5000  0.5000  1
]