# generated using pymatgen
data_PrAu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.92367845
_cell_length_b   4.76891325
_cell_length_c   6.03127879
_cell_angle_alpha   90.00000000
_cell_angle_beta   71.01761257
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   PrAu
_chemical_formula_sum   'Pr2 Au2'
_cell_volume   106.71813958
_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
  Pr  Pr0  1  0.13618327  0.75000000  0.72763246  1.0
  Pr  Pr1  1  0.86381673  0.25000000  0.27236754  1.0
  Au  Au2  1  0.41362395  0.75000000  0.17275209  1.0
  Au  Au3  1  0.58637605  0.25000000  0.82724791  1.0