data_[Rb9Ba3In24]
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
]
_symmetry_space_group_name_H-M [R3m]
_cell_length_a [6.6874]
_cell_length_b [6.6874]
_cell_length_c [31.3875]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [160]
_chemical_formula_structural [Rb3BaIn8]
_chemical_formula_sum '[Rb9 Ba3 In24]'
_cell_volume [1215.6139]
_cell_formula_units_Z [3]
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  3  0.0000  0.0000  0.0011  1.0
  Rb  Rb1  3  0.0000  0.0000  0.3739  1.0
  Rb  Rb2  3  0.0000  0.0000  0.4980  1.0
  Ba  Ba3  3  0.0000  0.0000  0.8764  1.0
  In  In4  9  0.0024  0.5012  0.4389  1.0
  In  In5  9  0.1680  0.3361  0.2693  1.0
  In  In6  3  0.0000  0.0000  0.1861  1.0
  In  In7  3  0.0000  0.0000  0.6899  1.0
]