# generated using pymatgen
data_CeAu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.96183320
_cell_length_b   4.73360093
_cell_length_c   6.02124950
_cell_angle_alpha   90.00000000
_cell_angle_beta   70.79267056
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CeAu
_chemical_formula_sum   'Ce2 Au2'
_cell_volume   106.63510789
_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  1  0.13524327  0.75000000  0.72951446  1.0
  Ce  Ce1  1  0.86475673  0.25000000  0.27048554  1.0
  Au  Au2  1  0.41195623  0.75000000  0.17608654  1.0
  Au  Au3  1  0.58804377  0.25000000  0.82391346  1.0