# generated using pymatgen
data_Ba8Si43Au3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.41839406
_cell_length_b   10.41839728
_cell_length_c   10.41840200
_cell_angle_alpha   90.04282190
_cell_angle_beta   90.04281391
_cell_angle_gamma   90.04284543
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba8Si43Au3
_chemical_formula_sum   'Ba8 Si43 Au3'
_cell_volume   1130.84332986
_cell_formula_units_Z   1
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  0.25049361  0.25048098  0.25047701  1.0
  Ba  Ba1  1  0.74950682  0.74951991  0.74952217  1.0
  Ba  Ba2  1  0.49999705  0.73865549  0.26133933  1.0
  Ba  Ba3  1  0.73863706  0.26134420  0.49999620  1.0
  Ba  Ba4  1  0.26136217  0.50000540  0.73865965  1.0
  Ba  Ba5  1  0.00000251  0.73867282  0.26132357  1.0
  Ba  Ba6  1  0.73865424  0.26132979  0.00000259  1.0
  Ba  Ba7  1  0.26134485  0.99999618  0.73867400  1.0
  Si  Si8  1  0.43347317  0.43347257  0.43347001  1.0
  Si  Si9  1  0.06421944  0.06421495  0.06421830  1.0
  Si  Si10  1  0.06349279  0.43269915  0.06314064  1.0
  Si  Si11  1  0.43407296  0.06325107  0.43269996  1.0
  Si  Si12  1  0.43269827  0.06313714  0.06349096  1.0
  Si  Si13  1  0.06325530  0.43270318  0.43406876  1.0
  Si  Si14  1  0.06314214  0.06348822  0.43269451  1.0
  Si  Si15  1  0.43270265  0.43407359  0.06325342  1.0
  Si  Si16  1  0.56729631  0.93674538  0.56592767  1.0
  Si  Si17  1  0.93685980  0.56730596  0.93651186  1.0
  Si  Si18  1  0.93578210  0.93578054  0.93578492  1.0
  Si  Si19  1  0.56652660  0.56652967  0.56652828  1.0
  Si  Si20  1  0.93674583  0.56593103  0.56729745  1.0
  Si  Si21  1  0.56730104  0.93650809  0.93686289  1.0
  Si  Si22  1  0.56592604  0.56729985  0.93674896  1.0
  Si  Si23  1  0.93650887  0.93685881  0.56730182  1.0
  Si  Si24  1  0.24844025  0.55373659  0.36954839  1.0
  Si  Si25  1  0.55373430  0.36955400  0.24843451  1.0
  Si  Si26  1  0.36955583  0.24843574  0.55373313  1.0
  Si  Si27  1  0.24801223  0.94229938  0.13142064  1.0
  Si  Si28  1  0.94230203  0.13141914  0.24800577  1.0
  Si  Si29  1  0.13142487  0.24800549  0.94230432  1.0
  Si  Si30  1  0.24843488  0.55417300  0.12971354  1.0
  Si  Si31  1  0.94339121  0.36694830  0.24836017  1.0
  Si  Si32  1  0.24836579  0.94339005  0.36694251  1.0
  Si  Si33  1  0.55417032  0.12971125  0.24842978  1.0
  Si  Si34  1  0.36694720  0.24836113  0.94339566  1.0
  Si  Si35  1  0.12971805  0.24843122  0.55416956  1.0
  Si  Si36  1  0.63305039  0.05660589  0.75163985  1.0
  Si  Si37  1  0.75156535  0.87028502  0.44582745  1.0
  Si  Si38  1  0.44626468  0.75156420  0.63044713  1.0
  Si  Si39  1  0.87028303  0.44583060  0.75156983  1.0
  Si  Si40  1  0.75163504  0.63305671  0.05660900  1.0
  Si  Si41  1  0.05770143  0.75199209  0.86858119  1.0
  Si  Si42  1  0.86857591  0.05769574  0.75199525  1.0
  Si  Si43  1  0.75198864  0.86857812  0.05769965  1.0
  Si  Si44  1  0.63044261  0.44626404  0.75156577  1.0
  Si  Si45  1  0.75155998  0.63045050  0.44626276  1.0
  Si  Si46  1  0.05661029  0.75163860  0.63305292  1.0
  Si  Si47  1  0.44582906  0.75156950  0.87028906  1.0
  Si  Si48  1  0.00000114  0.25098471  0.74901672  1.0
  Si  Si49  1  0.25099156  0.74901545  0.00000262  1.0
  Si  Si50  1  0.74901073  0.99999696  0.25098332  1.0
  Au  Au51  1  0.49999321  0.25066105  0.74934507  1.0
  Au  Au52  1  0.25067154  0.74933731  0.49999670  1.0
  Au  Au53  1  0.74932883  0.50000422  0.25066080  1.0