# generated using pymatgen
data_CaDy(Al5Ru)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.82186462
_cell_length_b   6.82175817
_cell_length_c   9.07482537
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   96.95634377
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaDy(Al5Ru)4
_chemical_formula_sum   'Ca1 Dy1 Al20 Ru4'
_cell_volume   419.20736609
_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
  Ca  Ca0  1  0.12584605  0.87413539  0.25000000  1.0
  Dy  Dy1  1  0.87453791  0.12546960  0.75000000  1.0
  Al  Al2  1  0.59134338  0.86002244  0.25000000  1.0
  Al  Al3  1  0.78154972  0.52175178  0.25000000  1.0
  Al  Al4  1  0.15487765  0.84510892  0.90027902  1.0
  Al  Al5  1  0.41155085  0.13820998  0.75000000  1.0
  Al  Al6  1  0.62328123  0.37672363  0.94837325  1.0
  Al  Al7  1  0.84017138  0.15985360  0.39994147  1.0
  Al  Al8  1  0.77424573  0.77343374  0.99915417  1.0
  Al  Al9  1  0.86179178  0.58843751  0.75000000  1.0
  Al  Al10  1  0.84017138  0.15985360  0.10005853  1.0
  Al  Al11  1  0.21951014  0.47993161  0.75000000  1.0
  Al  Al12  1  0.15487765  0.84510892  0.59972098  1.0
  Al  Al13  1  0.77424573  0.77343374  0.50084583  1.0
  Al  Al14  1  0.47824754  0.21845523  0.25000000  1.0
  Al  Al15  1  0.62328123  0.37672363  0.55162675  1.0
  Al  Al16  1  0.22656625  0.22576480  0.50084645  1.0
  Al  Al17  1  0.37691607  0.62307122  0.45899653  1.0
  Al  Al18  1  0.13996802  0.40866023  0.25000000  1.0
  Al  Al19  1  0.52008242  0.78049276  0.75000000  1.0
  Al  Al20  1  0.37691607  0.62307122  0.04100347  1.0
  Al  Al21  1  0.22656625  0.22576480  0.99915355  1.0
  Ru  Ru22  1  0.50133010  0.99960015  0.99941015  1.0
  Ru  Ru23  1  0.50133010  0.99960015  0.50058985  1.0
  Ru  Ru24  1  0.00039619  0.49866219  0.99941031  1.0
  Ru  Ru25  1  0.00039619  0.49866219  0.50058969  1.0