# generated using pymatgen
data_Zr2U(AlRu2)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.46813574
_cell_length_b   6.32997141
_cell_length_c   13.33299184
_cell_angle_alpha   90.00000000
_cell_angle_beta   89.99996464
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr2U(AlRu2)3
_chemical_formula_sum   'Zr4 U2 Al6 Ru12'
_cell_volume   377.09929488
_cell_formula_units_Z   2
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  0.99998869  0.50000100  0.33805680  1.0
  Zr  Zr1  1  0.49999872  0.00000000  0.50265166  1.0
  Zr  Zr2  1  0.00001046  0.50000100  0.66398260  1.0
  Zr  Zr3  1  0.50001150  0.00000000  0.82861779  1.0
  U  U4  1  0.99999906  0.50000100  0.99601735  1.0
  U  U5  1  0.49998949  0.00000000  0.17067100  1.0
  Al  Al6  1  0.00000721  0.00000000  0.99455272  1.0
  Al  Al7  1  0.49999604  0.50000100  0.17212557  1.0
  Al  Al8  1  0.99998626  0.00000000  0.34251904  1.0
  Al  Al9  1  0.50000095  0.50000100  0.50300639  1.0
  Al  Al10  1  0.00001128  0.00000000  0.66363311  1.0
  Al  Al11  1  0.50000813  0.50000100  0.82414277  1.0
  Ru  Ru12  1  0.49999798  0.24296969  0.00320317  1.0
  Ru  Ru13  1  0.49999798  0.75702931  0.00320317  1.0
  Ru  Ru14  1  0.99998872  0.25698860  0.16349710  1.0
  Ru  Ru15  1  0.99998872  0.74301140  0.16349710  1.0
  Ru  Ru16  1  0.49998885  0.24456639  0.32824474  1.0
  Ru  Ru17  1  0.49998885  0.75543361  0.32824474  1.0
  Ru  Ru18  1  0.99999887  0.24939034  0.49876597  1.0
  Ru  Ru19  1  0.99999887  0.75060966  0.49876597  1.0
  Ru  Ru20  1  0.50001425  0.25061819  0.66786919  1.0
  Ru  Ru21  1  0.50001425  0.74938181  0.66786919  1.0
  Ru  Ru22  1  0.00000645  0.25543237  0.83843195  1.0
  Ru  Ru23  1  0.00000645  0.74456763  0.83843195  1.0