data_[Ce4Zn2Cu2Au12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Zn  1.6500  1.3500  0.8800
  Cu  1.9000  1.3500  0.8200
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [12.4945]
_cell_length_b [5.4659]
_cell_length_c [8.7796]
_cell_angle_alpha [90.0000]
_cell_angle_beta [132.2168]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ce2ZnCuAu6]
_chemical_formula_sum '[Ce4 Zn2 Cu2 Au12]'
_cell_volume [444.0587]
_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
[
  Ce  Ce0  4  0.2389  0.5000  0.7117  1
  Zn  Zn1  2  0.0000  0.5000  0.0000  1
  Cu  Cu2  2  0.0000  0.0000  0.5000  1
  Au  Au3  8  0.0264  0.2490  0.2756  1
  Au  Au4  4  0.2463  0.0000  0.9002  1
]