data_[Ga8Te4Au4Se24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ga  1.8100  1.3000  0.7600
  Te  2.1000  1.4000  1.2933
  Au  2.5400  1.3500  1.0700
  Se  2.5500  1.1500  1.0133
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [12.7902]
_cell_length_b [11.3552]
_cell_length_c [7.3666]
_cell_angle_alpha [90.0000]
_cell_angle_beta [99.4743]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Ga2TeAuSe6]
_chemical_formula_sum '[Ga8 Te4 Au4 Se24]'
_cell_volume [1055.3058]
_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
[
  Ga  Ga0  8  0.1872  0.4142  0.7325  1
  Te  Te1  4  0.0000  0.2570  0.2500  1
  Au  Au2  4  0.0000  0.0971  0.7500  1
  Se  Se3  8  0.1142  0.0794  0.1475  1
  Se  Se4  8  0.1352  0.2218  0.5984  1
  Se  Se5  8  0.1424  0.4121  0.0467  1
]