# generated using pymatgen
data_ZrHg(Pd2Au)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.85707363
_cell_length_b   5.85216511
_cell_length_c   7.83547034
_cell_angle_alpha   90.00006848
_cell_angle_beta   89.99991140
_cell_angle_gamma   89.99979289
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrHg(Pd2Au)2
_chemical_formula_sum   'Zr2 Hg2 Pd8 Au4'
_cell_volume   268.57298456
_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  0.24999855  0.24999848  0.00000093  1.0
  Zr  Zr1  1  0.75000134  0.75000155  0.99999054  1.0
  Hg  Hg2  1  0.74995755  0.74999799  0.50001153  1.0
  Hg  Hg3  1  0.25004327  0.25000201  0.49999439  1.0
  Pd  Pd4  1  0.50000315  0.99999717  0.24193200  1.0
  Pd  Pd5  1  0.50000235  0.50000372  0.24193679  1.0
  Pd  Pd6  1  0.99999197  0.99999929  0.24196512  1.0
  Pd  Pd7  1  0.99999808  0.50000058  0.24196809  1.0
  Pd  Pd8  1  0.00001141  0.99999779  0.75803528  1.0
  Pd  Pd9  1  0.00000530  0.50000234  0.75803235  1.0
  Pd  Pd10  1  0.49999332  0.99999974  0.75806840  1.0
  Pd  Pd11  1  0.49999412  0.49999935  0.75806364  1.0
  Au  Au12  1  0.75001129  0.24999880  0.99999572  1.0
  Au  Au13  1  0.24998723  0.75000118  0.99999989  1.0
  Au  Au14  1  0.75002134  0.25000007  0.50000900  1.0
  Au  Au15  1  0.24997873  0.74999993  0.49999734  1.0