data_[Rb9Sc9V3Se24]
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
  V  1.6300  1.3500  0.7775
  Se  2.5500  1.1500  1.0133
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [7.7921]
_cell_length_b [7.7921]
_cell_length_c [24.4710]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [166]
_chemical_formula_structural [Rb3Sc3VSe8]
_chemical_formula_sum '[Rb9 Sc9 V3 Se24]'
_cell_volume [1286.7349]
_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  9  0.0000  0.5000  0.0000  1.0
  Sc  Sc1  9  0.0000  0.5000  0.5000  1.0
  V  V2  3  -0.0000  -0.0000  0.5000  1.0
  Se  Se3  18  0.0145  0.5073  0.2265  1.0
  Se  Se4  6  0.0000  0.0000  0.2290  1.0
]