# generated using pymatgen
data_Zr5P12PdRu18
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.41374499
_cell_length_b   12.41374403
_cell_length_c   3.88902028
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.73028167
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr5P12PdRu18
_chemical_formula_sum   'Zr5 P12 Pd1 Ru18'
_cell_volume   515.14950768
_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  0.18827401  0.18827401  0.50000000  1.0
  Zr  Zr1  1  0.81184787  0.00129496  0.50000000  1.0
  Zr  Zr2  1  0.00129496  0.81184787  0.50000000  1.0
  Zr  Zr3  1  0.32888817  0.66921699  0.00000000  1.0
  Zr  Zr4  1  0.66921699  0.32888817  0.00000000  1.0
  P  P5  1  0.81496587  0.81496587  0.00000000  1.0
  P  P6  1  0.17948649  0.00100777  0.00000000  1.0
  P  P7  1  0.00100777  0.17948649  0.00000000  1.0
  P  P8  1  0.17377552  0.48150358  0.50000000  1.0
  P  P9  1  0.51782243  0.69976354  0.50000000  1.0
  P  P10  1  0.30717880  0.83104924  0.50000000  1.0
  P  P11  1  0.69976354  0.51782243  0.50000000  1.0
  P  P12  1  0.83104924  0.30717880  0.50000000  1.0
  P  P13  1  0.48150358  0.17377552  0.50000000  1.0
  P  P14  1  0.36177961  0.36177961  0.00000000  1.0
  P  P15  1  0.62883735  0.99921599  0.00000000  1.0
  P  P16  1  0.99921599  0.62883735  0.00000000  1.0
  Pd  Pd17  1  0.55138215  0.55138215  0.00000000  1.0
  Ru  Ru18  1  0.44544256  0.00218155  0.00000000  1.0
  Ru  Ru19  1  0.00218155  0.44544256  0.00000000  1.0
  Ru  Ru20  1  0.71572269  0.71572269  0.50000000  1.0
  Ru  Ru21  1  0.27968378  0.00169434  0.50000000  1.0
  Ru  Ru22  1  0.00169434  0.27968378  0.50000000  1.0
  Ru  Ru23  1  0.18552297  0.37656934  0.00000000  1.0
  Ru  Ru24  1  0.62204608  0.80776626  0.00000000  1.0
  Ru  Ru25  1  0.18803116  0.81709390  0.00000000  1.0
  Ru  Ru26  1  0.80776626  0.62204608  0.00000000  1.0
  Ru  Ru27  1  0.81709390  0.18803116  0.00000000  1.0
  Ru  Ru28  1  0.37656934  0.18552297  0.00000000  1.0
  Ru  Ru29  1  0.36630373  0.49661955  0.50000000  1.0
  Ru  Ru30  1  0.50700511  0.87658400  0.50000000  1.0
  Ru  Ru31  1  0.13084424  0.63620184  0.50000000  1.0
  Ru  Ru32  1  0.87658400  0.50700511  0.50000000  1.0
  Ru  Ru33  1  0.63620184  0.13084424  0.50000000  1.0
  Ru  Ru34  1  0.49661955  0.36630373  0.50000000  1.0
  Ru  Ru35  1  0.99739656  0.99739656  0.00000000  1.0