data_[Sn2Sb2S4Cl2]
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
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [5.9906]
_cell_length_b [5.5943]
_cell_length_c [9.3985]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.8159]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [SnSbS2Cl]
_chemical_formula_sum '[Sn2 Sb2 S4 Cl2]'
_cell_volume [299.8708]
_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
[
  Sn  Sn0  2  0.3469  0.7500  0.1376  1.0
  Sb  Sb1  2  0.3137  0.7500  0.5759  1.0
  S  S2  2  0.3862  0.2500  0.5654  1.0
  S  S3  2  0.4209  0.2500  0.1753  1.0
  Cl  Cl4  2  0.0357  0.2500  0.7915  1.0
]