data_[Fe4Sn4Te12Au4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Fe  1.8300  1.4000  0.8525
  Sn  1.9600  1.4500  0.8300
  Te  2.1000  1.4000  1.2933
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [Cmcm]
_cell_length_a [3.7454]
_cell_length_b [14.6149]
_cell_length_c [11.1616]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [63]
_chemical_formula_structural [FeSnTe3Au]
_chemical_formula_sum '[Fe4 Sn4 Te12 Au4]'
_cell_volume [610.9604]
_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
[
  Fe  Fe0  4  0.0000  0.5000  0.0000  1
  Sn  Sn1  4  0.0000  0.1874  0.7500  1
  Te  Te2  8  0.0000  0.1237  0.0104  1
  Te  Te3  4  0.0000  0.4889  0.2500  1
  Au  Au4  4  0.0000  0.1678  0.2500  1
]