data_[Rb3Sc6Ag3Br24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rb  0.8200  2.3500  1.6600
  Sc  1.3600  1.6000  0.8850
  Ag  1.9300  1.6000  1.0867
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [R-3]
_cell_length_a [7.1036]
_cell_length_b [7.1036]
_cell_length_c [30.1901]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [148]
_chemical_formula_structural [RbSc2AgBr8]
_chemical_formula_sum '[Rb3 Sc6 Ag3 Br24]'
_cell_volume [1319.3433]
_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  0.5000  1.0
  Sc  Sc1  6  0.0000  0.0000  0.2544  1.0
  Ag  Ag2  3  0.0000  0.0000  0.0000  1.0
  Br  Br3  18  0.0050  0.6608  0.2764  1.0
  Br  Br4  6  0.0000  0.0000  0.1718  1.0
]