data_[K4Ga8Te4S24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Ga  1.8100  1.3000  0.7600
  Te  2.1000  1.4000  1.2933
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [11.8662]
_cell_length_b [12.7705]
_cell_length_c [6.8272]
_cell_angle_alpha [90.0000]
_cell_angle_beta [96.3323]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [KGa2TeS6]
_chemical_formula_sum '[K4 Ga8 Te4 S24]'
_cell_volume [1028.2566]
_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
[
  K  K0  4  0.0000  0.0604  0.7500  1
  Ga  Ga1  8  0.1921  0.4092  0.7224  1
  Te  Te2  4  0.0000  0.2771  0.2500  1
  S  S3  8  0.1215  0.2566  0.5964  1
  S  S4  8  0.1272  0.1448  0.1258  1
  S  S5  8  0.1622  0.4375  0.0552  1
]