data_[Rb8Sr4In4Br20]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rb  0.8200  2.3500  1.6600
  Sr  0.9500  2.0000  1.3200
  In  1.7800  1.5500  0.9400
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [4.7037]
_cell_length_b [20.1886]
_cell_length_c [16.0056]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [Rb2SrInBr5]
_chemical_formula_sum '[Rb8 Sr4 In4 Br20]'
_cell_volume [1519.8891]
_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  0.0760  0.6489  1.0
  Rb  Rb1  4  0.0000  0.1323  0.2977  1.0
  Sr  Sr2  4  0.0000  0.2347  0.0325  1.0
  In  In3  4  0.0000  0.4502  0.4470  1.0
  Br  Br4  4  0.0000  0.0882  0.0744  1.0
  Br  Br5  4  0.0000  0.2500  0.6611  1.0
  Br  Br6  4  0.0000  0.2884  0.4086  1.0
  Br  Br7  4  0.0000  0.3820  0.9895  1.0
  Br  Br8  4  0.0000  0.4941  0.7643  1.0
]