# generated using pymatgen
data_Zr6Al6Ru11Au
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.44162780
_cell_length_b   6.29748869
_cell_length_c   13.31249121
_cell_angle_alpha   90.00005161
_cell_angle_beta   90.00022198
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr6Al6Ru11Au
_chemical_formula_sum   'Zr6 Al6 Ru11 Au1'
_cell_volume   372.36503388
_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
  Zr  Zr0  1  0.99999900  0.51436544  0.00000000  1.0
  Zr  Zr1  1  0.49999126  0.99488373  0.17297269  1.0
  Zr  Zr2  1  0.99999196  0.49848819  0.33457595  1.0
  Zr  Zr3  1  0.50000000  0.00072755  0.50000000  1.0
  Zr  Zr4  1  0.00000704  0.49848919  0.66542405  1.0
  Zr  Zr5  1  0.50000874  0.99488373  0.82702731  1.0
  Al  Al6  1  0.00000000  0.98841598  1.00000000  1.0
  Al  Al7  1  0.49998712  0.50700173  0.17256853  1.0
  Al  Al8  1  0.00000194  0.99919102  0.33430105  1.0
  Al  Al9  1  0.50000000  0.49926355  0.50000000  1.0
  Al  Al10  1  0.99999806  0.99919102  0.66569795  1.0
  Al  Al11  1  0.50001288  0.50700173  0.82743147  1.0
  Ru  Ru12  1  0.50000000  0.75224138  0.00000000  1.0
  Ru  Ru13  1  0.99998983  0.24997361  0.16445030  1.0
  Ru  Ru14  1  0.99998698  0.75035789  0.16598487  1.0
  Ru  Ru15  1  0.49999392  0.25024539  0.33279238  1.0
  Ru  Ru16  1  0.49999356  0.74864477  0.33461262  1.0
  Ru  Ru17  1  0.00000100  0.24887879  0.50000000  1.0
  Ru  Ru18  1  0.00000100  0.75008382  0.50000000  1.0
  Ru  Ru19  1  0.50000608  0.25024339  0.66720762  1.0
  Ru  Ru20  1  0.50000644  0.74864577  0.66538738  1.0
  Ru  Ru21  1  0.00001017  0.24997361  0.83554870  1.0
  Ru  Ru22  1  0.00001202  0.75035889  0.83401713  1.0
  Au  Au23  1  0.50000000  0.24845382  1.00000000  1.0