data_[Rb1Li2Hf1Cl8]
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
  Hf  1.3000  1.5500  0.8500
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [5.6632]
_cell_length_b [6.3365]
_cell_length_c [9.3738]
_cell_angle_alpha [87.6148]
_cell_angle_beta [73.5546]
_cell_angle_gamma [89.9792]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [RbLi2HfCl8]
_chemical_formula_sum '[Rb1 Li2 Hf1 Cl8]'
_cell_volume [322.3165]
_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  0.0000  0.0000  0.5000  1.0
  Li  Li1  2  0.4426  0.4822  0.2040  1.0
  Hf  Hf2  1  0.0000  0.0000  0.0000  1.0
  Cl  Cl3  2  0.1618  0.8038  0.1793  1.0
  Cl  Cl4  2  0.2531  0.3153  0.0100  1.0
  Cl  Cl5  2  0.2635  0.4953  0.4826  1.0
  Cl  Cl6  2  0.3214  0.8634  0.7871  1.0
]