data_[Rb2V6Br24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rb  0.8200  2.3500  1.6600
  V  1.6300  1.3500  0.7775
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [P6_3/m]
_cell_length_a [13.4604]
_cell_length_b [13.4604]
_cell_length_c [9.1276]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [176]
_chemical_formula_structural [Rb(VBr4)3]
_chemical_formula_sum '[Rb2 V6 Br24]'
_cell_volume [1432.2045]
_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  0.3333  0.6667  0.2500  1
  V  V1  6  0.0979  0.7153  0.7500  1
  Br  Br2  12  0.2141  0.7729  0.5422  1
  Br  Br3  6  0.0129  0.1983  0.2500  1
  Br  Br4  6  0.0166  0.4843  0.2500  1
]