# generated using pymatgen
data_Au
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.03410808
_cell_length_b   5.75776876
_cell_length_c   46.39795672
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Au
_chemical_formula_sum   Au28
_cell_volume   1077.70675198
_cell_formula_units_Z   28
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
  Au  Au1  1  0.005440  0.375816  0.295649  1
  Au  Au2  1  0.505440  0.625816  0.324368  1
  Au  Au3  1  0.505440  0.125816  0.324368  1
  Au  Au4  1  0.005440  0.875816  0.295649  1
  Au  Au5  1  0.005440  0.875816  0.355947  1
  Au  Au6  1  0.505440  0.125816  0.387458  1
  Au  Au7  1  0.505440  0.625816  0.387458  1
  Au  Au8  1  0.005440  0.375816  0.355947  1
  Au  Au9  1  0.005440  0.375816  0.418780  1
  Au  Au10  1  0.505440  0.625816  0.450144  1
  Au  Au11  1  0.505440  0.125816  0.450144  1
  Au  Au12  1  0.005440  0.875816  0.418780  1
  Au  Au13  1  0.005440  0.875816  0.481509  1
  Au  Au14  1  0.505440  0.125816  0.512873  1
  Au  Au15  1  0.505440  0.625816  0.512873  1
  Au  Au16  1  0.005440  0.375816  0.481509  1
  Au  Au17  1  0.005440  0.375816  0.544239  1
  Au  Au18  1  0.505440  0.625816  0.575602  1
  Au  Au19  1  0.505440  0.125816  0.575602  1
  Au  Au20  1  0.005440  0.875816  0.544239  1
  Au  Au21  1  0.005440  0.875816  0.606925  1
  Au  Au22  1  0.505440  0.125816  0.638435  1
  Au  Au23  1  0.505440  0.625816  0.638435  1
  Au  Au24  1  0.005440  0.375816  0.606925  1
  Au  Au25  1  0.005440  0.375816  0.670014  1
  Au  Au26  1  0.505440  0.625816  0.698733  1
  Au  Au27  1  0.505440  0.125816  0.698733  1
  Au  Au28  1  0.005440  0.875816  0.670014  1
