data_[Sn4Sb8S16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sn  1.9600  1.4500  0.8300
  Sb  2.0500  1.4500  0.8300
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [Cmcm]
_cell_length_a [3.9347]
_cell_length_b [13.0388]
_cell_length_c [13.7007]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [63]
_chemical_formula_structural [Sn(SbS2)2]
_chemical_formula_sum '[Sn4 Sb8 S16]'
_cell_volume [702.8950]
_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
[
  Sn  Sn0  4  0.0000  0.4095  0.2500  1.0
  Sb  Sb1  8  0.0000  0.1388  0.0612  1.0
  S  S2  8  0.0000  0.2280  0.6141  1.0
  S  S3  4  0.0000  0.0476  0.2500  1.0
  S  S4  4  0.0000  0.5000  0.0000  1.0
]