data_[Cs2Ba2Ru2O8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Ba  0.8900  2.1500  1.4900
  Ru  2.2000  1.3000  0.6610
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [6.7701]
_cell_length_b [6.1486]
_cell_length_c [8.0861]
_cell_angle_alpha [90.0000]
_cell_angle_beta [105.4803]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [CsBaRuO4]
_chemical_formula_sum '[Cs2 Ba2 Ru2 O8]'
_cell_volume [324.3831]
_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
[
  Cs  Cs0  2  0.2598  0.7500  0.0565  1.0
  Ba  Ba1  2  0.2091  0.7500  0.5473  1.0
  Ru  Ru2  2  0.2605  0.2500  0.3329  1.0
  O  O3  4  0.0487  0.0379  0.3004  1.0
  O  O4  2  0.4008  0.2500  0.5568  1.0
  O  O5  2  0.4068  0.2500  0.1774  1.0
]