data_[Er4Ga2Au2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Er  1.2400  1.7500  1.0300
  Ga  1.8100  1.3000  0.7600
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [5.8585]
_cell_length_b [4.4371]
_cell_length_c [7.6818]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.7110]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [Er2GaAu]
_chemical_formula_sum '[Er4 Ga2 Au2]'
_cell_volume [187.9853]
_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  2  0.2108  0.7500  0.9331  1.0
  Er  Er1  2  0.2206  0.7500  0.4203  1.0
  Ga  Ga2  2  0.3240  0.2500  0.7070  1.0
  Au  Au3  2  0.3457  0.2500  0.2076  1.0
]