# generated using pymatgen
data_HPd3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.46633534
_cell_length_b   6.60768488
_cell_length_c   50.00914973
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   104.10609151
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HPd3
_chemical_formula_sum   'H16 Pd48'
_cell_volume   1751.85393467
_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  0.383735  0.162703  0.297118  1
  H  H2  1  0.721779  0.562918  0.294923  1
  H  H3  1  0.386765  0.073364  0.360462  1
  H  H4  1  0.719307  0.452352  0.342938  1
  H  H5  1  0.356950  0.973485  0.418884  1
  H  H6  1  0.712067  0.368961  0.401012  1
  H  H7  1  0.336781  0.869204  0.475018  1
  H  H8  1  0.690785  0.264905  0.456916  1
  H  H9  1  0.316646  0.766407  0.531048  1
  H  H10  1  0.670650  0.162108  0.512945  1
  H  H11  1  0.295364  0.662351  0.586951  1
  H  H12  1  0.650481  0.057827  0.569079  1
  H  H13  1  0.288124  0.578960  0.645025  1
  H  H14  1  0.620666  0.957948  0.627501  1
  H  H15  1  0.285652  0.468394  0.693040  1
  H  H16  1  0.623696  0.868609  0.690845  1
  Pd  Pd17  1  0.133981  0.235333  0.288560  1
  Pd  Pd18  1  0.329121  0.900962  0.299282  1
  Pd  Pd19  1  0.643684  0.308662  0.284107  1
  Pd  Pd20  1  0.975592  0.529518  0.317883  1
  Pd  Pd21  1  0.802334  0.837140  0.298411  1
  Pd  Pd22  1  0.463194  0.514972  0.320231  1
  Pd  Pd23  1  0.141003  0.125546  0.338675  1
  Pd  Pd24  1  0.302731  0.786295  0.354825  1
  Pd  Pd25  1  0.650232  0.145385  0.334301  1
  Pd  Pd26  1  0.962462  0.414242  0.371871  1
  Pd  Pd27  1  0.794729  0.771616  0.355091  1
  Pd  Pd28  1  0.462723  0.399777  0.373476  1
  Pd  Pd29  1  0.123257  0.031899  0.393461  1
  Pd  Pd30  1  0.287456  0.676467  0.409853  1
  Pd  Pd31  1  0.625143  0.045259  0.390869  1
  Pd  Pd32  1  0.942544  0.310378  0.428221  1
  Pd  Pd33  1  0.781317  0.662269  0.410452  1
  Pd  Pd34  1  0.442855  0.299704  0.429656  1
  Pd  Pd35  1  0.105309  0.927525  0.448349  1
  Pd  Pd36  1  0.266658  0.574555  0.465816  1
  Pd  Pd37  1  0.605466  0.938819  0.446635  1
  Pd  Pd38  1  0.922593  0.205717  0.483902  1
  Pd  Pd39  1  0.761185  0.560535  0.466467  1
  Pd  Pd40  1  0.422726  0.195271  0.485319  1
  Pd  Pd41  1  0.084838  0.825595  0.504061  1
  Pd  Pd42  1  0.246246  0.470778  0.521496  1
  Pd  Pd43  1  0.584705  0.836041  0.502644  1
  Pd  Pd44  1  0.902122  0.103787  0.539614  1
  Pd  Pd45  1  0.740772  0.456757  0.522147  1
  Pd  Pd46  1  0.401965  0.092493  0.541328  1
  Pd  Pd47  1  0.064886  0.720934  0.559742  1
  Pd  Pd48  1  0.226113  0.369044  0.577511  1
  Pd  Pd49  1  0.564576  0.731608  0.558307  1
  Pd  Pd50  1  0.884174  0.999414  0.594503  1
  Pd  Pd51  1  0.719975  0.354846  0.578110  1
  Pd  Pd52  1  0.382288  0.986053  0.597094  1
  Pd  Pd53  1  0.044969  0.617070  0.616092  1
  Pd  Pd54  1  0.212702  0.259697  0.632872  1
  Pd  Pd55  1  0.544708  0.631535  0.614487  1
  Pd  Pd56  1  0.866428  0.905766  0.649289  1
  Pd  Pd57  1  0.704700  0.245017  0.633138  1
  Pd  Pd58  1  0.357199  0.885927  0.653662  1
  Pd  Pd59  1  0.031839  0.501794  0.670080  1
  Pd  Pd60  1  0.205096  0.194172  0.689552  1
  Pd  Pd61  1  0.544237  0.516340  0.667732  1
  Pd  Pd62  1  0.873450  0.795979  0.699404  1
  Pd  Pd63  1  0.678310  0.130350  0.688682  1
  Pd  Pd64  1  0.363747  0.722650  0.703856  1
