data_[Cs4Rb8Ga4I16]
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
  Ga  1.8100  1.3000  0.7600
  I  2.6600  1.4000  1.2733
]
_symmetry_space_group_name_H-M [Cmcm]
_cell_length_a [5.4669]
_cell_length_b [17.5945]
_cell_length_c [17.8669]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [63]
_chemical_formula_structural [CsRb2GaI4]
_chemical_formula_sum '[Cs4 Rb8 Ga4 I16]'
_cell_volume [1718.5643]
_cell_formula_units_Z [4]
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  4  0.0000  0.1199  0.7500  1.0
  Rb  Rb1  8  0.0000  0.3725  0.5536  1.0
  Ga  Ga2  4  0.0000  0.1429  0.2500  1.0
  I  I3  8  0.0000  0.2644  0.1245  1.0
  I  I4  4  0.0000  0.0000  0.0000  1.0
  I  I5  4  0.0000  0.4569  0.7500  1.0
]