# generated using pymatgen
data_HPd3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.77790445
_cell_length_b   11.45686692
_cell_length_c   50.32789549
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.03253985
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HPd3
_chemical_formula_sum   'H16 Pd48'
_cell_volume   1601.73944898
_cell_formula_units_Z   16
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
  H  H1  1  0.751797  0.803074  0.355897  1
  H  H2  1  0.846816  0.215505  0.292961  1
  H  H3  1  0.820923  0.768806  0.285905  1
  H  H4  1  0.353960  0.411662  0.299598  1
  H  H5  1  0.917659  0.013793  0.479585  1
  H  H6  1  0.189740  0.409680  0.412719  1
  H  H7  1  0.232667  0.012977  0.378110  1
  H  H8  1  0.911024  0.635677  0.444532  1
  H  H9  1  0.942499  0.205092  0.605538  1
  H  H10  1  0.165189  0.564895  0.533053  1
  H  H11  1  0.399432  0.234704  0.505118  1
  H  H12  1  0.483227  0.815290  0.562070  1
  H  H13  1  0.444650  0.385986  0.725837  1
  H  H14  1  0.447197  0.817435  0.660236  1
  H  H15  1  0.437533  0.414484  0.625451  1
  H  H16  1  0.944641  0.031246  0.721386  1
  Pd  Pd17  1  0.255594  0.704158  0.372125  1
  Pd  Pd18  1  0.404678  0.105026  0.307098  1
  Pd  Pd19  1  0.791461  0.713704  0.323814  1
  Pd  Pd20  1  0.187259  0.316729  0.379556  1
  Pd  Pd21  1  0.259535  0.915795  0.341372  1
  Pd  Pd22  1  0.345815  0.293465  0.278929  1
  Pd  Pd23  1  0.706176  0.114331  0.361026  1
  Pd  Pd24  1  0.853690  0.499263  0.293378  1
  Pd  Pd25  1  0.868026  0.908826  0.290243  1
  Pd  Pd26  1  0.380267  0.497815  0.342178  1
  Pd  Pd27  1  0.323089  0.707474  0.276460  1
  Pd  Pd28  1  0.884868  0.298601  0.327201  1
  Pd  Pd29  1  0.385537  0.911547  0.495595  1
  Pd  Pd30  1  0.696375  0.299825  0.427901  1
  Pd  Pd31  1  0.942623  0.913329  0.446530  1
  Pd  Pd32  1  0.393263  0.498297  0.502853  1
  Pd  Pd33  1  0.449236  0.108802  0.463857  1
  Pd  Pd34  1  0.683055  0.511613  0.397675  1
  Pd  Pd35  1  0.931716  0.299677  0.483536  1
  Pd  Pd36  1  0.445562  0.713366  0.428348  1
  Pd  Pd37  1  0.215435  0.099024  0.409650  1
  Pd  Pd38  1  0.932878  0.698073  0.477641  1
  Pd  Pd39  1  0.746471  0.902794  0.391175  1
  Pd  Pd40  1  0.174838  0.495378  0.447935  1
  Pd  Pd41  1  0.441645  0.121149  0.625487  1
  Pd  Pd42  1  0.697155  0.504148  0.554817  1
  Pd  Pd43  1  0.956199  0.123330  0.574936  1
  Pd  Pd44  1  0.447293  0.715797  0.627617  1
  Pd  Pd45  1  0.443365  0.321803  0.592402  1
  Pd  Pd46  1  0.477431  0.708957  0.528090  1
  Pd  Pd47  1  0.937869  0.516400  0.611127  1
  Pd  Pd48  1  0.966232  0.912234  0.546102  1
  Pd  Pd49  1  0.220407  0.304118  0.536922  1
  Pd  Pd50  1  0.467512  0.913353  0.593651  1
  Pd  Pd51  1  0.752880  0.112496  0.517786  1
  Pd  Pd52  1  -0.005588  0.709909  0.577238  1
  Pd  Pd53  1  0.944484  0.330793  0.739052  1
  Pd  Pd54  1  0.945691  0.716092  0.676085  1
  Pd  Pd55  1  0.443636  0.323233  0.692352  1
  Pd  Pd56  1  0.946126  0.910670  0.736518  1
  Pd  Pd57  1  0.943650  0.517284  0.710937  1
  Pd  Pd58  1  0.949405  0.916209  0.643016  1
  Pd  Pd59  1  0.445044  0.711607  0.722590  1
  Pd  Pd60  1  0.945124  0.121624  0.677916  1
  Pd  Pd61  1  0.442405  0.518032  0.661400  1
  Pd  Pd62  1  0.445046  0.118051  0.726536  1
  Pd  Pd63  1  0.940058  0.319966  0.643194  1
  Pd  Pd64  1  0.446867  0.916613  0.690817  1
