# generated using pymatgen
data_Hg3Pd8Se9
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.55458959
_cell_length_b   7.27844689
_cell_length_c   16.98729192
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hg3Pd8Se9
_chemical_formula_sum   'Hg6 Pd16 Se18'
_cell_volume   810.41668036
_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
  Hg  Hg0  1  0.12337987  0.50000000  0.29479275  1.0
  Hg  Hg1  1  0.12337987  0.50000000  0.70520725  1.0
  Hg  Hg2  1  0.87662013  0.00000000  0.20520725  1.0
  Hg  Hg3  1  0.87662013  0.00000000  0.79479275  1.0
  Hg  Hg4  1  0.28913849  0.50000000  0.00000000  1.0
  Hg  Hg5  1  0.71086151  0.00000000  0.50000000  1.0
  Pd  Pd6  1  0.53148666  0.50000000  0.76322693  1.0
  Pd  Pd7  1  0.53148666  0.50000000  0.23677307  1.0
  Pd  Pd8  1  0.46851334  0.00000000  0.73677307  1.0
  Pd  Pd9  1  0.46851334  0.00000000  0.26322693  1.0
  Pd  Pd10  1  0.95874729  0.26216344  0.41072065  1.0
  Pd  Pd11  1  0.95874729  0.73783656  0.41072065  1.0
  Pd  Pd12  1  0.95874729  0.26216344  0.58927935  1.0
  Pd  Pd13  1  0.95874729  0.73783656  0.58927935  1.0
  Pd  Pd14  1  0.04125271  0.23783656  0.08927935  1.0
  Pd  Pd15  1  0.04125271  0.76216344  0.08927935  1.0
  Pd  Pd16  1  0.04125271  0.23783656  0.91072065  1.0
  Pd  Pd17  1  0.04125271  0.76216344  0.91072065  1.0
  Pd  Pd18  1  0.39628460  0.50000000  0.41548210  1.0
  Pd  Pd19  1  0.39628460  0.50000000  0.58451790  1.0
  Pd  Pd20  1  0.60371540  0.00000000  0.08451790  1.0
  Pd  Pd21  1  0.60371540  0.00000000  0.91548210  1.0
  Se  Se22  1  0.61347231  0.26556526  0.34036956  1.0
  Se  Se23  1  0.61347231  0.73443474  0.34036956  1.0
  Se  Se24  1  0.61347231  0.26556526  0.65963044  1.0
  Se  Se25  1  0.61347231  0.73443474  0.65963044  1.0
  Se  Se26  1  0.38652769  0.23443474  0.15963044  1.0
  Se  Se27  1  0.38652769  0.76556526  0.15963044  1.0
  Se  Se28  1  0.38652769  0.23443474  0.84036956  1.0
  Se  Se29  1  0.38652769  0.76556526  0.84036956  1.0
  Se  Se30  1  0.89814846  0.50000000  0.83254160  1.0
  Se  Se31  1  0.89814846  0.50000000  0.16745840  1.0
  Se  Se32  1  0.10185154  0.00000000  0.66745840  1.0
  Se  Se33  1  0.10185154  0.00000000  0.33254160  1.0
  Se  Se34  1  0.26299294  0.75497484  0.50000000  1.0
  Se  Se35  1  0.26299294  0.24502516  0.50000000  1.0
  Se  Se36  1  0.73700706  0.74502516  0.00000000  1.0
  Se  Se37  1  0.73700706  0.25497484  0.00000000  1.0
  Se  Se38  1  0.80500378  0.50000000  0.50000000  1.0
  Se  Se39  1  0.19499622  0.00000000  0.00000000  1.0