# generated using pymatgen
data_Ba2PtAu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.84985700
_cell_length_b   12.07031900
_cell_length_c   13.47430700
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba2PtAu
_chemical_formula_sum   'Ba12 Pt6 Au6'
_cell_volume   788.77678400
_cell_formula_units_Z   6
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
  Ba  Ba0  1  0.00000000  0.13240300  0.57915100  1.0
  Ba  Ba1  1  0.50000000  0.35753100  0.41207800  1.0
  Ba  Ba2  1  0.00000000  0.63240300  0.42084900  1.0
  Ba  Ba3  1  0.00000000  0.14169600  0.25470000  1.0
  Ba  Ba4  1  0.50000000  0.86681100  0.24435700  1.0
  Ba  Ba5  1  0.50000000  0.36397700  0.08223100  1.0
  Ba  Ba6  1  0.00000000  0.63881500  0.08409600  1.0
  Ba  Ba7  1  0.00000000  0.13881500  0.91590400  1.0
  Ba  Ba8  1  0.50000000  0.86397700  0.91776900  1.0
  Ba  Ba9  1  0.50000000  0.36681100  0.75564300  1.0
  Ba  Ba10  1  0.00000000  0.64169600  0.74530000  1.0
  Ba  Ba11  1  0.50000000  0.85753100  0.58792200  1.0
  Pt  Pt12  1  0.50000000  0.57461900  0.58349000  1.0
  Pt  Pt13  1  0.50000000  0.07461900  0.41651000  1.0
  Pt  Pt14  1  0.00000000  0.42444200  0.25102200  1.0
  Pt  Pt15  1  0.00000000  0.92542100  0.08405500  1.0
  Pt  Pt16  1  0.00000000  0.42542100  0.91594500  1.0
  Pt  Pt17  1  0.00000000  0.92444200  0.74897800  1.0
  Au  Au18  1  0.00000000  0.92336800  0.41538900  1.0
  Au  Au19  1  0.50000000  0.57426000  0.24967900  1.0
  Au  Au20  1  0.50000000  0.07659700  0.08213400  1.0
  Au  Au21  1  0.50000000  0.57659700  0.91786600  1.0
  Au  Au22  1  0.50000000  0.07426000  0.75032100  1.0
  Au  Au23  1  0.00000000  0.42336800  0.58461100  1.0