data_[Cs1Ga1S2O8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Ga  1.8100  1.3000  0.7600
  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 [4.8544]
_cell_length_b [4.9760]
_cell_length_c [9.0357]
_cell_angle_alpha [74.6173]
_cell_angle_beta [77.4900]
_cell_angle_gamma [62.6592]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [CsGa(SO4)2]
_chemical_formula_sum '[Cs1 Ga1 S2 O8]'
_cell_volume [185.7842]
_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  0.0000  0.0000  1.0
  Ga  Ga1  1  0.5000  0.5000  0.5000  1.0
  S  S2  2  0.1846  0.2202  0.3197  1.0
  O  O3  2  0.1658  0.5997  0.6763  1.0
  O  O4  2  0.2526  0.8836  0.3571  1.0
  O  O5  2  0.2948  0.2876  0.4401  1.0
  O  O6  2  0.3212  0.2981  0.1632  1.0
]