# generated using pymatgen
data_BaCuSnAu5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.25819291
_cell_length_b   9.29409330
_cell_length_c   10.25172687
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaCuSnAu5
_chemical_formula_sum   'Ba4 Cu4 Sn4 Au20'
_cell_volume   691.56429275
_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
  Ba  Ba0  1  0.25000000  0.24091824  0.11074697  1.0
  Ba  Ba1  1  0.25000000  0.74091824  0.38925303  1.0
  Ba  Ba2  1  0.75000000  0.75908176  0.88925303  1.0
  Ba  Ba3  1  0.75000000  0.25908176  0.61074697  1.0
  Cu  Cu4  1  0.25000000  0.07510629  0.61369150  1.0
  Cu  Cu5  1  0.25000000  0.57510629  0.88630850  1.0
  Cu  Cu6  1  0.75000000  0.92489371  0.38630850  1.0
  Cu  Cu7  1  0.75000000  0.42489371  0.11369150  1.0
  Sn  Sn8  1  0.25000000  0.34389403  0.47669837  1.0
  Sn  Sn9  1  0.25000000  0.84389403  0.02330163  1.0
  Sn  Sn10  1  0.75000000  0.65610597  0.52330163  1.0
  Sn  Sn11  1  0.75000000  0.15610597  0.97669837  1.0
  Au  Au12  1  0.05556437  0.08976408  0.39468489  1.0
  Au  Au13  1  0.44443563  0.58976408  0.10531511  1.0
  Au  Au14  1  0.55556437  0.91023592  0.60531511  1.0
  Au  Au15  1  0.94443563  0.41023592  0.89468489  1.0
  Au  Au16  1  0.94443563  0.91023592  0.60531511  1.0
  Au  Au17  1  0.55556437  0.41023592  0.89468489  1.0
  Au  Au18  1  0.44443563  0.08976408  0.39468489  1.0
  Au  Au19  1  0.05556437  0.58976408  0.10531511  1.0
  Au  Au20  1  0.04292909  0.07704969  0.83179288  1.0
  Au  Au21  1  0.45707091  0.57704969  0.66820712  1.0
  Au  Au22  1  0.54292909  0.92295031  0.16820712  1.0
  Au  Au23  1  0.95707091  0.42295031  0.33179288  1.0
  Au  Au24  1  0.95707091  0.92295031  0.16820712  1.0
  Au  Au25  1  0.54292909  0.42295031  0.33179288  1.0
  Au  Au26  1  0.45707091  0.07704969  0.83179288  1.0
  Au  Au27  1  0.04292909  0.57704969  0.66820712  1.0
  Au  Au28  1  0.25000000  0.32516243  0.74367201  1.0
  Au  Au29  1  0.25000000  0.82516243  0.75632799  1.0
  Au  Au30  1  0.75000000  0.67483757  0.25632799  1.0
  Au  Au31  1  0.75000000  0.17483757  0.24367201  1.0