data_[Cs6Ga2Te6]
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
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [P6_3/mmc]
_cell_length_a [11.3719]
_cell_length_b [11.3719]
_cell_length_c [7.7234]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [194]
_chemical_formula_structural [Cs3GaTe3]
_chemical_formula_sum '[Cs6 Ga2 Te6]'
_cell_volume [864.9798]
_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  6  0.1871  0.3742  0.7500  1.0
  Ga  Ga1  2  0.3333  0.6667  0.2500  1.0
  Te  Te2  6  0.2033  0.4065  0.2500  1.0
]