data_[Er8Te2Au2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Er  1.2400  1.7500  1.0300
  Te  2.1000  1.4000  1.2933
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [5.9425]
_cell_length_b [8.2219]
_cell_length_c [7.8222]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.7915]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [Er4TeAu]
_chemical_formula_sum '[Er8 Te2 Au2]'
_cell_volume [363.9051]
_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
[
  Er  Er0  4  0.0331  0.5439  0.7350  1
  Er  Er1  2  0.4088  0.7500  0.5061  1
  Er  Er2  2  0.4309  0.2500  0.9987  1
  Te  Te3  2  0.1072  0.7500  0.0779  1
  Au  Au4  2  0.1597  0.2500  0.5792  1
]