data_[Sr8In4Te4S20]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  In  1.7800  1.5500  0.9400
  Te  2.1000  1.4000  1.2933
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [4.3032]
_cell_length_b [17.5135]
_cell_length_c [12.3901]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [Sr2InTeS5]
_chemical_formula_sum '[Sr8 In4 Te4 S20]'
_cell_volume [933.7644]
_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
[
  Sr  Sr0  4  0.0000  0.1051  0.6923  1.0
  Sr  Sr1  4  0.0000  0.1347  0.3185  1.0
  In  In2  4  0.0000  0.4378  0.4432  1.0
  Te  Te3  4  0.0000  0.2206  0.0412  1.0
  S  S4  4  0.0000  0.0472  0.0538  1.0
  S  S5  4  0.0000  0.2801  0.6492  1.0
  S  S6  4  0.0000  0.3147  0.3414  1.0
  S  S7  4  0.0000  0.3589  0.0070  1.0
  S  S8  4  0.0000  0.4842  0.7774  1.0
]