data_[Rb1Li1Fe2Cl6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rb  0.8200  2.3500  1.6600
  Li  0.9800  1.4500  0.9000
  Fe  1.8300  1.4000  0.8525
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [6.2524]
_cell_length_b [6.7198]
_cell_length_c [7.9695]
_cell_angle_alpha [102.1371]
_cell_angle_beta [91.7222]
_cell_angle_gamma [111.0089]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [RbLi(FeCl3)2]
_chemical_formula_sum '[Rb1 Li1 Fe2 Cl6]'
_cell_volume [303.5475]
_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  1  0.5298  0.0689  0.5634  1
  Li  Li1  1  0.8814  0.9422  0.9572  1
  Fe  Fe2  1  0.2960  0.5260  0.9630  1
  Fe  Fe3  1  0.8427  0.5078  0.2469  1
  Cl  Cl4  1  0.0107  0.6648  0.5148  1
  Cl  Cl5  1  0.0550  0.7127  0.0630  1
  Cl  Cl6  1  0.0858  0.1852  0.7938  1
  Cl  Cl7  1  0.4774  0.5274  0.2204  1
  Cl  Cl8  1  0.5427  0.6904  0.7853  1
  Cl  Cl9  1  0.7663  0.1403  0.1947  1
]