data_[Ce2Pd14Au10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Pd  2.2000  1.4000  0.8462
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [Imm2]
_cell_length_a [5.4966]
_cell_length_b [9.2975]
_cell_length_c [9.3023]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [44]
_chemical_formula_structural [CePd7Au5]
_chemical_formula_sum '[Ce2 Pd14 Au10]'
_cell_volume [475.3883]
_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  2  0.0000  0.0000  0.0125  1.0
  Pd  Pd1  4  0.0000  0.2809  0.4989  1.0
  Pd  Pd2  4  0.0000  0.3464  0.9987  1.0
  Pd  Pd3  2  0.0000  0.0000  0.3491  1.0
  Pd  Pd4  2  0.0000  0.0000  0.6521  1.0
  Pd  Pd5  2  0.0000  0.5000  0.7084  1.0
  Au  Au6  8  0.2494  0.2525  0.7489  1.0
  Au  Au7  2  0.0000  0.5000  0.2870  1.0
]