data_[Rb2Tl1Re1Cl8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rb  0.8200  2.3500  1.6600
  Tl  1.6200  1.9000  1.3325
  Re  1.9000  1.3500  0.7125
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [6.5534]
_cell_length_b [7.2354]
_cell_length_c [9.0654]
_cell_angle_alpha [89.3133]
_cell_angle_beta [89.0866]
_cell_angle_gamma [88.1017]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Rb2TlReCl8]
_chemical_formula_sum '[Rb2 Tl1 Re1 Cl8]'
_cell_volume [429.5295]
_cell_formula_units_Z [1]
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  0.4839  0.5004  0.7617  1.0
  Tl  Tl1  1  0.0000  0.0000  0.5000  1.0
  Re  Re2  1  0.0000  0.0000  0.0000  1.0
  Cl  Cl3  2  0.1707  0.7091  0.0109  1.0
  Cl  Cl4  2  0.2156  0.1106  0.1818  1.0
  Cl  Cl5  2  0.2229  0.0941  0.8092  1.0
  Cl  Cl6  2  0.2548  0.6863  0.4939  1.0
]