data_[Cs2Ga2Sb2S8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Ga  1.8100  1.3000  0.7600
  Sb  2.0500  1.4500  0.8300
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [6.4235]
_cell_length_b [6.9514]
_cell_length_c [9.0547]
_cell_angle_alpha [90.0000]
_cell_angle_beta [97.9151]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [CsGaSbS4]
_chemical_formula_sum '[Cs2 Ga2 Sb2 S8]'
_cell_volume [400.4618]
_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
[
  Cs  Cs0  2  0.2796  0.2500  0.9315  1
  Ga  Ga1  2  0.1448  0.2500  0.3446  1
  Sb  Sb2  2  0.3318  0.7500  0.5515  1
  S  S3  4  0.3772  0.0020  0.3105  1
  S  S4  2  0.0497  0.2500  0.5747  1
  S  S5  2  0.1702  0.7500  0.8027  1
]