data_[Rb2Ga2I6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  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 [P1]
_cell_length_a [5.9688]
_cell_length_b [9.6498]
_cell_length_c [9.7006]
_cell_angle_alpha [63.1071]
_cell_angle_beta [89.3754]
_cell_angle_gamma [89.3281]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [RbGaI3]
_chemical_formula_sum '[Rb2 Ga2 I6]'
_cell_volume [498.2696]
_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  1  0.5383  0.3177  0.8168  1.0
  Rb  Rb1  1  0.9337  0.8427  0.3396  1.0
  Ga  Ga2  1  0.7424  0.7031  0.9528  1.0
  Ga  Ga3  1  0.7632  0.2966  0.3553  1.0
  I  I4  1  0.0417  0.4247  0.5587  1.0
  I  I5  1  0.4303  0.1001  0.2347  1.0
  I  I6  1  0.4974  0.6221  0.2021  1.0
  I  I7  1  0.5220  0.7618  0.7042  1.0
  I  I8  1  0.9600  0.9517  0.9038  1.0
  I  I9  1  0.9944  0.4577  0.0208  1.0
]