data_[Cs2Rb13]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Rb  0.8200  2.3500  1.6600
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [8.1185]
_cell_length_b [12.8387]
_cell_length_c [14.6135]
_cell_angle_alpha [104.2926]
_cell_angle_beta [93.6234]
_cell_angle_gamma [100.5952]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Cs2Rb13]
_chemical_formula_sum '[Cs2 Rb13]'
_cell_volume [1441.4152]
_cell_formula_units_Z [1]
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
[
  Cs  Cs0  2  0.3962  0.8002  0.5352  1.0
  Rb  Rb1  2  0.0093  0.9938  0.3278  1.0
  Rb  Rb2  2  0.1950  0.3998  0.9295  1.0
  Rb  Rb3  2  0.1977  0.4084  0.6017  1.0
  Rb  Rb4  2  0.2113  0.3965  0.2589  1.0
  Rb  Rb5  2  0.3936  0.8021  0.8726  1.0
  Rb  Rb6  2  0.4060  0.7922  0.1939  1.0
  Rb  Rb7  1  0.0000  0.0000  0.0000  1.0
]