# generated using pymatgen
data_Pd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.46899948
_cell_length_b   12.18192796
_cell_length_c   48.44524655
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   102.92096638
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Pd
_chemical_formula_sum   Pd96
_cell_volume   3145.84182277
_cell_formula_units_Z   96
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
  Pd  Pd1  1  0.288313  0.736551  0.286585  1
  Pd  Pd2  1  0.445084  0.050043  0.302398  1
  Pd  Pd3  1  0.604117  0.368228  0.321221  1
  Pd  Pd4  1  0.604117  0.868228  0.321221  1
  Pd  Pd5  1  0.288313  0.236551  0.286585  1
  Pd  Pd6  1  0.445084  0.550043  0.302398  1
  Pd  Pd7  1  0.104117  0.868228  0.321221  1
  Pd  Pd8  1  0.788313  0.236551  0.286585  1
  Pd  Pd9  1  0.945084  0.550043  0.302398  1
  Pd  Pd10  1  0.788313  0.736551  0.286585  1
  Pd  Pd11  1  0.945084  0.050043  0.302398  1
  Pd  Pd12  1  0.104117  0.368228  0.321221  1
  Pd  Pd13  1  0.760689  0.681486  0.339572  1
  Pd  Pd14  1  0.919215  0.998572  0.357969  1
  Pd  Pd15  1  0.076736  0.313705  0.376384  1
  Pd  Pd16  1  0.076736  0.813705  0.376384  1
  Pd  Pd17  1  0.760689  0.181486  0.339572  1
  Pd  Pd18  1  0.919215  0.498572  0.357969  1
  Pd  Pd19  1  0.576736  0.813705  0.376384  1
  Pd  Pd20  1  0.260689  0.181486  0.339572  1
  Pd  Pd21  1  0.419215  0.498572  0.357969  1
  Pd  Pd22  1  0.260689  0.681486  0.339572  1
  Pd  Pd23  1  0.419215  0.998572  0.357969  1
  Pd  Pd24  1  0.576736  0.313705  0.376384  1
  Pd  Pd25  1  0.234514  0.629332  0.395226  1
  Pd  Pd26  1  0.392110  0.944600  0.413682  1
  Pd  Pd27  1  0.549951  0.260358  0.432333  1
  Pd  Pd28  1  0.549951  0.760358  0.432333  1
  Pd  Pd29  1  0.234514  0.129332  0.395226  1
  Pd  Pd30  1  0.392110  0.444600  0.413682  1
  Pd  Pd31  1  0.049951  0.760358  0.432333  1
  Pd  Pd32  1  0.734514  0.129332  0.395226  1
  Pd  Pd33  1  0.892110  0.444600  0.413682  1
  Pd  Pd34  1  0.734514  0.629332  0.395226  1
  Pd  Pd35  1  0.892110  0.944600  0.413682  1
  Pd  Pd36  1  0.049951  0.260358  0.432333  1
  Pd  Pd37  1  0.707589  0.575711  0.450927  1
  Pd  Pd38  1  0.865367  0.891331  0.469530  1
  Pd  Pd39  1  0.023074  0.206810  0.488107  1
  Pd  Pd40  1  0.023074  0.706810  0.488107  1
  Pd  Pd41  1  0.707589  0.075711  0.450927  1
  Pd  Pd42  1  0.865367  0.391331  0.469530  1
  Pd  Pd43  1  0.523074  0.706810  0.488107  1
  Pd  Pd44  1  0.207589  0.075711  0.450927  1
  Pd  Pd45  1  0.365367  0.391331  0.469530  1
  Pd  Pd46  1  0.207589  0.575711  0.450927  1
  Pd  Pd47  1  0.365367  0.891331  0.469530  1
  Pd  Pd48  1  0.523074  0.206810  0.488107  1
  Pd  Pd49  1  0.180821  0.522371  0.506731  1
  Pd  Pd50  1  0.338527  0.837849  0.525309  1
  Pd  Pd51  1  0.496306  0.153469  0.543911  1
  Pd  Pd52  1  0.496306  0.653469  0.543911  1
  Pd  Pd53  1  0.180821  0.022371  0.506731  1
  Pd  Pd54  1  0.338527  0.337849  0.525309  1
  Pd  Pd55  1  0.996306  0.653469  0.543911  1
  Pd  Pd56  1  0.680821  0.022371  0.506731  1
  Pd  Pd57  1  0.838527  0.337849  0.525309  1
  Pd  Pd58  1  0.680821  0.522371  0.506731  1
  Pd  Pd59  1  0.838527  0.837849  0.525309  1
  Pd  Pd60  1  0.996306  0.153469  0.543911  1
  Pd  Pd61  1  0.653944  0.468822  0.562505  1
  Pd  Pd62  1  0.811785  0.784580  0.581156  1
  Pd  Pd63  1  0.969381  0.099848  0.599612  1
  Pd  Pd64  1  0.969381  0.599848  0.599612  1
  Pd  Pd65  1  0.653944  0.968822  0.562505  1
  Pd  Pd66  1  0.811785  0.284580  0.581156  1
  Pd  Pd67  1  0.469381  0.599848  0.599612  1
  Pd  Pd68  1  0.153944  0.968822  0.562505  1
  Pd  Pd69  1  0.311785  0.284580  0.581156  1
  Pd  Pd70  1  0.153944  0.468822  0.562505  1
  Pd  Pd71  1  0.311785  0.784580  0.581156  1
  Pd  Pd72  1  0.469381  0.099848  0.599612  1
  Pd  Pd73  1  0.127158  0.415475  0.618454  1
  Pd  Pd74  1  0.284680  0.730608  0.636870  1
  Pd  Pd75  1  0.443206  0.047695  0.655266  1
  Pd  Pd76  1  0.443206  0.547695  0.655266  1
  Pd  Pd77  1  0.127158  0.915475  0.618454  1
  Pd  Pd78  1  0.284680  0.230608  0.636870  1
  Pd  Pd79  1  0.943206  0.547695  0.655266  1
  Pd  Pd80  1  0.627158  0.915475  0.618454  1
  Pd  Pd81  1  0.784680  0.230608  0.636870  1
  Pd  Pd82  1  0.627158  0.415475  0.618454  1
  Pd  Pd83  1  0.784680  0.730608  0.636870  1
  Pd  Pd84  1  0.943206  0.047695  0.655266  1
  Pd  Pd85  1  0.599778  0.360952  0.673617  1
  Pd  Pd86  1  0.758811  0.679137  0.692440  1
  Pd  Pd87  1  0.915581  0.992629  0.708253  1
  Pd  Pd88  1  0.915581  0.492629  0.708253  1
  Pd  Pd89  1  0.599778  0.860952  0.673617  1
  Pd  Pd90  1  0.758811  0.179137  0.692440  1
  Pd  Pd91  1  0.415581  0.492629  0.708253  1
  Pd  Pd92  1  0.099778  0.860952  0.673617  1
  Pd  Pd93  1  0.258811  0.179137  0.692440  1
  Pd  Pd94  1  0.099778  0.360952  0.673617  1
  Pd  Pd95  1  0.258811  0.679137  0.692440  1
  Pd  Pd96  1  0.415581  0.992629  0.708253  1
