data_[Rb2Ga4I6]
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 [P2_1/m]
_cell_length_a [8.3381]
_cell_length_b [4.8343]
_cell_length_c [12.8424]
_cell_angle_alpha [90.0000]
_cell_angle_beta [102.5626]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [RbGa2I3]
_chemical_formula_sum '[Rb2 Ga4 I6]'
_cell_volume [505.2652]
_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  0.4683  0.2500  0.1721  1.0
  Ga  Ga1  2  0.0135  0.2500  0.8211  1.0
  Ga  Ga2  2  0.2422  0.2500  0.5051  1.0
  I  I3  2  0.1152  0.7500  0.6544  1.0
  I  I4  2  0.2169  0.7500  0.9922  1.0
  I  I5  2  0.3464  0.7500  0.3543  1.0
]