# generated using pymatgen
data_Zr3In3PdRu5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.56974241
_cell_length_b   6.50949366
_cell_length_c   13.66936010
_cell_angle_alpha   90.00000000
_cell_angle_beta   89.99995640
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr3In3PdRu5
_chemical_formula_sum   'Zr6 In6 Pd2 Ru10'
_cell_volume   406.61848016
_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  0.00001603  0.00000000  0.00764950  1.0
  Zr  Zr1  1  0.50002286  0.50000100  0.16790822  1.0
  Zr  Zr2  1  0.00000987  0.00000000  0.33336494  1.0
  Zr  Zr3  1  0.49999099  0.50000100  0.49875148  1.0
  Zr  Zr4  1  0.99997314  0.00000000  0.65898319  1.0
  Zr  Zr5  1  0.49999232  0.50000100  0.83332692  1.0
  In  In6  1  0.00001974  0.50000100  0.00282182  1.0
  In  In7  1  0.50003043  0.00000000  0.16729404  1.0
  In  In8  1  0.00002040  0.50000100  0.33331878  1.0
  In  In9  1  0.49999014  0.00000000  0.49935166  1.0
  In  In10  1  0.99996562  0.50000100  0.66386699  1.0
  In  In11  1  0.49998177  0.00000000  0.83334888  1.0
  Pd  Pd12  1  0.99998906  0.25081112  0.83335140  1.0
  Pd  Pd13  1  0.99998906  0.74918788  0.83335140  1.0
  Ru  Ru14  1  0.50001219  0.24962864  0.99733029  1.0
  Ru  Ru15  1  0.50001219  0.75037036  0.99733029  1.0
  Ru  Ru16  1  0.00002060  0.24934308  0.16593912  1.0
  Ru  Ru17  1  0.00002060  0.75065592  0.16593912  1.0
  Ru  Ru18  1  0.50001519  0.24950795  0.33333842  1.0
  Ru  Ru19  1  0.50001519  0.75049305  0.33333842  1.0
  Ru  Ru20  1  0.99999074  0.24940048  0.50072512  1.0
  Ru  Ru21  1  0.99999074  0.75059952  0.50072512  1.0
  Ru  Ru22  1  0.49996656  0.24959928  0.66932293  1.0
  Ru  Ru23  1  0.49996656  0.75040172  0.66932293  1.0