data_[In4Te2Au2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  In  1.7800  1.5500  0.9400
  Te  2.1000  1.4000  1.2933
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [Cmm2]
_cell_length_a [4.5056]
_cell_length_b [5.6252]
_cell_length_c [8.2978]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [35]
_chemical_formula_structural [In2TeAu]
_chemical_formula_sum '[In4 Te2 Au2]'
_cell_volume [210.3044]
_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
[
  In  In0  2  0.0000  0.0000  0.0396  1
  In  In1  2  0.0000  0.5000  0.7471  1
  Te  Te2  2  0.0000  0.0000  0.4725  1
  Au  Au3  2  0.0000  0.5000  0.2408  1
]