data_[Ce2Al3Sn1Au4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Al  1.6100  1.2500  0.6750
  Sn  1.9600  1.4500  0.8300
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [P-4m2]
_cell_length_a [4.4162]
_cell_length_b [4.4162]
_cell_length_c [10.9854]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [115]
_chemical_formula_structural [Ce2Al3SnAu4]
_chemical_formula_sum '[Ce2 Al3 Sn1 Au4]'
_cell_volume [214.2473]
_cell_formula_units_Z [1]
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  0.5000  0.7612  1
  Al  Al1  2  0.0000  0.5000  0.1244  1
  Al  Al2  1  0.0000  0.0000  0.5000  1
  Sn  Sn3  1  0.5000  0.5000  0.5000  1
  Au  Au4  2  0.0000  0.5000  0.3509  1
  Au  Au5  1  0.0000  0.0000  0.0000  1
  Au  Au6  1  0.5000  0.5000  0.0000  1
]