data_[Rb2Ba4In4I14]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rb  0.8200  2.3500  1.6600
  Ba  0.8900  2.1500  1.4900
  In  1.7800  1.5500  0.9400
  I  2.6600  1.4000  1.2733
]
_symmetry_space_group_name_H-M [Imm2]
_cell_length_a [6.9462]
_cell_length_b [27.8067]
_cell_length_c [6.9319]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [44]
_chemical_formula_structural [RbBa2In2I7]
_chemical_formula_sum '[Rb2 Ba4 In4 I14]'
_cell_volume [1338.9084]
_cell_formula_units_Z [2]
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  0.0000  0.5000  0.8141  1.0
  Ba  Ba1  4  0.0000  0.1211  0.0032  1.0
  In  In2  4  0.0000  0.2516  0.5111  1.0
  I  I3  4  0.0000  0.1296  0.5062  1.0
  I  I4  4  0.0000  0.2451  0.0091  1.0
  I  I5  4  0.0000  0.3891  0.5076  1.0
  I  I6  2  0.0000  0.0000  0.1127  1.0
]