data_[La6Ru2Au2Cl2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Ru  2.2000  1.3000  0.6610
  Au  2.5400  1.3500  1.0700
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [8.7683]
_cell_length_b [4.3383]
_cell_length_c [9.9512]
_cell_angle_alpha [90.0000]
_cell_angle_beta [93.8822]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [La3RuAuCl]
_chemical_formula_sum '[La6 Ru2 Au2 Cl2]'
_cell_volume [377.6743]
_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
[
  La  La0  2  0.1387  0.7500  0.8731  1
  La  La1  2  0.3172  0.2500  0.5920  1
  La  La2  2  0.4064  0.2500  0.1482  1
  Ru  Ru3  2  0.3617  0.2500  0.8426  1
  Au  Au4  2  0.1418  0.7500  0.1829  1
  Cl  Cl5  2  0.1052  0.7500  0.5829  1
]