data_[Sr4Ti2S6O2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  Ti  1.5400  1.4000  0.8517
  S  2.5800  1.0000  0.8800
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [Immm]
_cell_length_a [3.9121]
_cell_length_b [4.7913]
_cell_length_c [15.5639]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [71]
_chemical_formula_structural [Sr2TiS3O]
_chemical_formula_sum '[Sr4 Ti2 S6 O2]'
_cell_volume [291.7335]
_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
[
  Sr  Sr0  4  0.0000  0.0000  0.3545  1.0
  Ti  Ti1  2  0.0000  0.0000  0.0000  1.0
  S  S2  4  0.0000  0.0000  0.1622  1.0
  S  S3  2  0.0000  0.5000  0.0000  1.0
  O  O4  2  0.0000  0.5000  0.5000  1.0
]