data_[La12Co2Ir2Au4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Co  1.8800  1.3500  0.7683
  Ir  2.2000  1.3500  0.7650
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [7.1023]
_cell_length_b [7.8342]
_cell_length_c [12.8238]
_cell_angle_alpha [90.0000]
_cell_angle_beta [122.8167]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [La6CoIrAu2]
_chemical_formula_sum '[La12 Co2 Ir2 Au4]'
_cell_volume [599.6577]
_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  4  0.1107  0.1887  0.9346  1.0
  La  La1  4  0.2507  0.6789  0.9359  1.0
  La  La2  4  0.3824  0.0304  0.7473  1.0
  Co  Co3  2  0.0000  0.0000  0.5000  1.0
  Ir  Ir4  2  0.5000  0.0000  0.0000  1.0
  Au  Au5  4  0.1959  0.1069  0.2455  1.0
]