# generated using pymatgen
data_Zr6Al6CuRu11
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.42116001
_cell_length_b   6.28281416
_cell_length_c   13.24180686
_cell_angle_alpha   89.99978211
_cell_angle_beta   89.99913058
_cell_angle_gamma   89.99895502
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr6Al6CuRu11
_chemical_formula_sum   'Zr6 Al6 Cu1 Ru11'
_cell_volume   367.82199517
_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  0.00004325  0.00237611  0.00170413  1.0
  Zr  Zr1  1  0.50013379  0.50086160  0.16687871  1.0
  Zr  Zr2  1  0.00010539  0.99932156  0.33329513  1.0
  Zr  Zr3  1  0.49998687  0.50086136  0.49975380  1.0
  Zr  Zr4  1  0.99989230  0.00236152  0.66499541  1.0
  Zr  Zr5  1  0.49984411  0.49362002  0.83337422  1.0
  Al  Al6  1  0.00001649  0.49571787  0.00247630  1.0
  Al  Al7  1  0.50008525  0.00113917  0.16664851  1.0
  Al  Al8  1  0.00006490  0.49971678  0.33331699  1.0
  Al  Al9  1  0.50000088  0.00113662  0.49999498  1.0
  Al  Al10  1  0.99987985  0.49571058  0.66419980  1.0
  Al  Al11  1  0.49992970  0.00628055  0.83335712  1.0
  Cu  Cu12  1  0.99982446  0.74941711  0.83339115  1.0
  Ru  Ru13  1  0.50002520  0.24981558  0.99811462  1.0
  Ru  Ru14  1  0.50005325  0.75047358  0.99613681  1.0
  Ru  Ru15  1  0.00012077  0.24992520  0.16612236  1.0
  Ru  Ru16  1  0.00013477  0.74996075  0.16508599  1.0
  Ru  Ru17  1  0.50010781  0.24957912  0.33328416  1.0
  Ru  Ru18  1  0.50011597  0.75038653  0.33328279  1.0
  Ru  Ru19  1  0.99999368  0.24990341  0.50050166  1.0
  Ru  Ru20  1  0.99999446  0.74998985  0.50152451  1.0
  Ru  Ru21  1  0.49987986  0.24983908  0.66860299  1.0
  Ru  Ru22  1  0.49989099  0.75044115  0.67058179  1.0
  Ru  Ru23  1  0.99988600  0.25116591  0.83338006  1.0