data_[Cs1Pd1S2O8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Pd  2.2000  1.4000  0.8462
  S  2.5800  1.0000  0.8800
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [4.3418]
_cell_length_b [5.4050]
_cell_length_c [9.2915]
_cell_angle_alpha [79.1316]
_cell_angle_beta [89.6627]
_cell_angle_gamma [77.0140]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [CsPd(SO4)2]
_chemical_formula_sum '[Cs1 Pd1 S2 O8]'
_cell_volume [208.5108]
_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  1  0.0000  0.5000  0.0000  1.0
  Pd  Pd1  1  0.0000  0.0000  0.5000  1.0
  S  S2  2  0.4671  0.1046  0.7302  1.0
  O  O3  2  0.2275  0.2102  0.5994  1.0
  O  O4  2  0.2467  0.0816  0.3212  1.0
  O  O5  2  0.3399  0.9453  0.8494  1.0
  O  O6  2  0.4410  0.6714  0.2337  1.0
]