data_[Rb8Li4Ga4I20]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rb  0.8200  2.3500  1.6600
  Li  0.9800  1.4500  0.9000
  Ga  1.8100  1.3000  0.7600
  I  2.6600  1.4000  1.2733
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [5.0980]
_cell_length_b [21.2143]
_cell_length_c [14.7911]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [Rb2LiGaI5]
_chemical_formula_sum '[Rb8 Li4 Ga4 I20]'
_cell_volume [1599.6557]
_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
[
  Rb  Rb0  4  0.0000  0.1231  0.6861  1.0
  Rb  Rb1  4  0.0000  0.1340  0.3286  1.0
  Li  Li2  4  0.0000  0.2236  0.0654  1.0
  Ga  Ga3  4  0.0000  0.4325  0.4364  1.0
  I  I4  4  0.0000  0.0517  0.0080  1.0
  I  I5  4  0.0000  0.3015  0.6524  1.0
  I  I6  4  0.0000  0.3157  0.3586  1.0
  I  I7  4  0.0000  0.3461  0.0100  1.0
  I  I8  4  0.0000  0.4974  0.7785  1.0
]