data_[Cs2Sn2S2O1]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Sn  1.9600  1.4500  0.8300
  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 [6.1276]
_cell_length_b [6.6231]
_cell_length_c [7.1110]
_cell_angle_alpha [106.9206]
_cell_angle_beta [101.4066]
_cell_angle_gamma [104.4562]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Cs2Sn2S2O]
_chemical_formula_sum '[Cs2 Sn2 S2 O1]'
_cell_volume [255.7121]
_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  0.2349  0.5991  0.2933  1.0
  Sn  Sn1  2  0.2506  0.0460  0.8516  1.0
  S  S2  2  0.3750  0.6936  0.8380  1.0
  O  O3  1  0.0000  0.0000  0.0000  1.0
]