data_[La18Ir6Rh3Au3]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Ir  2.2000  1.3500  0.7650
  Rh  2.2800  1.3500  0.7450
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [R3]
_cell_length_a [7.3523]
_cell_length_b [7.3523]
_cell_length_c [20.2443]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [146]
_chemical_formula_structural [La6Ir2RhAu]
_chemical_formula_sum '[La18 Ir6 Rh3 Au3]'
_cell_volume [947.7201]
_cell_formula_units_Z [3]
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  9  0.0022  0.3408  0.2527  1.0
  La  La1  9  0.0363  0.6943  0.0817  1.0
  Ir  Ir2  3  0.0000  0.0000  0.0008  1.0
  Ir  Ir3  3  0.0000  0.0000  0.5062  1.0
  Rh  Rh4  3  0.0000  0.0000  0.3270  1.0
  Au  Au5  3  0.0000  0.0000  0.8236  1.0
]