data_[Rb18As6Pd3]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rb  0.8200  2.3500  1.6600
  As  2.1800  1.1500  0.6600
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [6.1115]
_cell_length_b [6.1115]
_cell_length_c [32.3170]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [166]
_chemical_formula_structural [Rb6As2Pd]
_chemical_formula_sum '[Rb18 As6 Pd3]'
_cell_volume [1045.3510]
_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  6  0.0000  0.0000  0.1883  1.0
  Rb  Rb1  6  0.0000  0.0000  0.3024  1.0
  Rb  Rb2  6  0.0000  0.0000  0.4177  1.0
  As  As3  6  0.0000  0.0000  0.0794  1.0
  Pd  Pd4  3  0.0000  0.0000  0.0000  1.0
]