data_[Cs4Ba4N8O24]
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
  N  3.0400  0.6500  0.6300
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [9.5685]
_cell_length_b [10.8894]
_cell_length_c [7.9534]
_cell_angle_alpha [90.0000]
_cell_angle_beta [112.6644]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [CsBa(NO3)2]
_chemical_formula_sum '[Cs4 Ba4 N8 O24]'
_cell_volume [764.7115]
_cell_formula_units_Z [4]
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  4  0.0000  0.1335  0.7500  1
  Ba  Ba1  4  0.0000  0.3935  0.2500  1
  N  N2  8  0.2375  0.3856  0.7567  1
  O  O3  8  0.1032  0.3891  0.6243  1
  O  O4  8  0.1829  0.2135  0.2118  1
  O  O5  8  0.2238  0.0239  0.1280  1
]