# generated using pymatgen
data_LaAu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.89360139
_cell_length_b   7.65051533
_cell_length_c   5.88453816
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaAu
_chemical_formula_sum   'La4 Au4'
_cell_volume   220.30870826
_cell_formula_units_Z   4
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  1  0.75000000  0.81217318  0.35298778  1.0
  La  La1  1  0.25000000  0.18782682  0.64701222  1.0
  La  La2  1  0.25000000  0.68782682  0.85298778  1.0
  La  La3  1  0.75000000  0.31217318  0.14701222  1.0
  Au  Au4  1  0.75000000  0.96006924  0.84868582  1.0
  Au  Au5  1  0.25000000  0.03993076  0.15131418  1.0
  Au  Au6  1  0.25000000  0.53993076  0.34868582  1.0
  Au  Au7  1  0.75000000  0.46006924  0.65131418  1.0