data_[Cs2Rb1Zr1Cl8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Rb  0.8200  2.3500  1.6600
  Zr  1.3300  1.5500  0.8600
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [6.4570]
_cell_length_b [7.4468]
_cell_length_c [9.5227]
_cell_angle_alpha [90.5272]
_cell_angle_beta [105.1993]
_cell_angle_gamma [90.0185]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Cs2RbZrCl8]
_chemical_formula_sum '[Cs2 Rb1 Zr1 Cl8]'
_cell_volume [441.8525]
_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
[
  Cs  Cs0  2  0.3600  0.4983  0.2032  1.0
  Rb  Rb1  1  0.0000  0.0000  0.5000  1.0
  Zr  Zr2  1  0.0000  0.0000  0.0000  1.0
  Cl  Cl3  2  0.1697  0.7558  0.8892  1.0
  Cl  Cl4  2  0.1805  0.2282  0.8824  1.0
  Cl  Cl5  2  0.1845  0.5775  0.5095  1.0
  Cl  Cl6  2  0.3044  0.0034  0.2276  1.0
]