# generated using pymatgen
data_HPd3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.54293191
_cell_length_b   5.86736433
_cell_length_c   56.84430901
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   103.05952782
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HPd3
_chemical_formula_sum   'H16 Pd48'
_cell_volume   1800.89796419
_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  0.115657  1.114526  0.206303  1
  H  H2  1  0.282406  0.556365  0.205753  1
  H  H3  1  0.747885  0.787490  0.220043  1
  H  H4  1  0.396446  0.380830  0.252210  1
  H  H5  1  1.004100  0.856692  0.327756  1
  H  H6  1  0.489510  0.243518  0.309993  1
  H  H7  1  0.831420  0.694638  0.383021  1
  H  H8  1  0.314091  1.087640  0.365124  1
  H  H9  1  0.930088  0.529093  0.437770  1
  H  H10  1  0.412787  0.922116  0.419874  1
  H  H11  1  0.754791  0.373259  0.492893  1
  H  H12  1  0.240091  0.760046  0.475136  1
  H  H13  1  0.847749  0.235940  0.550674  1
  H  H14  1  0.496271  0.829269  0.582839  1
  H  H15  1  0.961687  1.060558  0.597139  1
  H  H16  1  0.128475  0.502379  0.596594  1
  Pd  Pd17  1  0.880270  0.239449  0.200865  1
  Pd  Pd18  1  1.012780  0.814881  0.205155  1
  Pd  Pd19  1  0.369498  0.305386  0.198090  1
  Pd  Pd20  1  0.675082  0.494645  0.233893  1
  Pd  Pd21  1  0.499374  0.811568  0.205621  1
  Pd  Pd22  1  0.170553  0.488806  0.234598  1
  Pd  Pd23  1  0.809125  1.038821  0.243329  1
  Pd  Pd24  1  0.981091  0.720753  0.269394  1
  Pd  Pd25  1  0.312759  1.063473  0.241549  1
  Pd  Pd26  1  0.618701  0.293778  0.278841  1
  Pd  Pd27  1  0.477543  0.717151  0.268966  1
  Pd  Pd28  1  0.124416  0.292522  0.279015  1
  Pd  Pd29  1  0.787471  0.957929  0.304439  1
  Pd  Pd30  1  0.926980  0.537215  0.315140  1
  Pd  Pd31  1  0.286721  0.956678  0.304376  1
  Pd  Pd32  1  0.592347  0.187339  0.340122  1
  Pd  Pd33  1  0.428971  0.528158  0.314989  1
  Pd  Pd34  1  0.094948  0.183102  0.340206  1
  Pd  Pd35  1  0.737845  0.759121  0.352186  1
  Pd  Pd36  1  0.900385  0.413673  0.377249  1
  Pd  Pd37  1  0.234636  0.766671  0.351456  1
  Pd  Pd38  1  0.539676  0.983164  0.389026  1
  Pd  Pd39  1  0.399369  0.403456  0.376905  1
  Pd  Pd40  1  0.042701  0.983728  0.388519  1
  Pd  Pd41  1  0.704485  0.633586  0.413866  1
  Pd  Pd42  1  0.844802  0.213297  0.425988  1
  Pd  Pd43  1  0.201462  0.633022  0.414373  1
  Pd  Pd44  1  0.506320  0.857625  0.450706  1
  Pd  Pd45  1  0.343786  0.203076  0.425645  1
  Pd  Pd46  1  1.009527  0.850072  0.451436  1
  Pd  Pd47  1  0.651835  0.429418  0.462772  1
  Pd  Pd48  1  0.815221  1.088603  0.487902  1
  Pd  Pd49  1  0.149236  0.433653  0.462688  1
  Pd  Pd50  1  0.456726  0.658833  0.498455  1
  Pd  Pd51  1  0.317216  1.079539  0.487752  1
  Pd  Pd52  1  0.957480  0.660090  0.498518  1
  Pd  Pd53  1  0.625521  0.322988  0.524053  1
  Pd  Pd54  1  0.766635  0.899614  0.533929  1
  Pd  Pd55  1  0.119781  0.324230  0.523879  1
  Pd  Pd56  1  0.435030  0.577970  0.559561  1
  Pd  Pd57  1  0.263096  0.896056  0.533499  1
  Pd  Pd58  1  0.931417  0.553330  0.561346  1
  Pd  Pd59  1  0.569087  1.122201  0.569000  1
  Pd  Pd60  1  0.744800  0.805298  0.597266  1
  Pd  Pd61  1  0.073607  0.128028  0.568296  1
  Pd  Pd62  1  0.363873  0.377439  0.602027  1
  Pd  Pd63  1  0.231407  0.802003  0.597734  1
  Pd  Pd64  1  0.874646  0.311506  0.604805  1
