data_[Er1Tm1In2Au4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Er  1.2400  1.7500  1.0300
  Tm  1.2500  1.7500  1.0950
  In  1.7800  1.5500  0.9400
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [P-6m2]
_cell_length_a [4.7284]
_cell_length_b [4.7284]
_cell_length_c [8.9679]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [187]
_chemical_formula_structural [ErTm(InAu2)2]
_chemical_formula_sum '[Er1 Tm1 In2 Au4]'
_cell_volume [173.6419]
_cell_formula_units_Z [1]
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  1  0.0000  0.0000  0.0000  1
  Tm  Tm1  1  0.3333  0.6667  0.5000  1
  In  In2  2  0.6667  0.3333  0.2503  1
  Au  Au3  2  0.0000  0.0000  0.3436  1
  Au  Au4  2  0.3333  0.6667  0.1573  1
]