data_[Cs2Tm2Au2Cl12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Tm  1.2500  1.7500  1.0950
  Au  2.5400  1.3500  1.0700
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2]
_cell_length_a [7.3974]
_cell_length_b [11.3046]
_cell_length_c [7.8362]
_cell_angle_alpha [90.0000]
_cell_angle_beta [95.7436]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [5]
_chemical_formula_structural [CsTmAuCl6]
_chemical_formula_sum '[Cs2 Tm2 Au2 Cl12]'
_cell_volume [652.0151]
_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
[
  Cs  Cs0  2  0.0000  0.0320  0.5000  1.0
  Tm  Tm1  2  0.0000  0.6807  0.0000  1.0
  Au  Au2  2  0.0000  0.3313  0.0000  1.0
  Cl  Cl3  4  0.1226  0.4923  0.1907  1.0
  Cl  Cl4  4  0.1532  0.8060  0.2383  1.0
  Cl  Cl5  4  0.1924  0.1788  0.1564  1.0
]