# generated using pymatgen
data_HPd3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.73395524
_cell_length_b   11.52691790
_cell_length_c   50.30385904
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.03254044
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HPd3
_chemical_formula_sum   'H16 Pd48'
_cell_volume   1585.27946108
_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  0.474716  0.749578  0.293692  1
  H  H2  1  0.751782  0.152312  0.278131  1
  H  H3  1  0.489572  0.949085  0.359584  1
  H  H4  1  0.215245  0.353268  0.281458  1
  H  H5  1  0.576422  0.977308  0.462141  1
  H  H6  1  0.807265  0.348160  0.377313  1
  H  H7  1  0.077732  0.189039  0.487462  1
  H  H8  1  0.361475  0.572311  0.434959  1
  H  H9  1  0.643943  0.163871  0.576579  1
  H  H10  1  0.926269  0.547117  0.524261  1
  H  H11  1  0.196359  0.387866  0.634470  1
  H  H12  1  0.427250  0.758772  0.549523  1
  H  H13  1  0.787685  0.382983  0.730273  1
  H  H14  1  0.514337  0.787211  0.652113  1
  H  H15  1  0.251398  0.583970  0.733570  1
  H  H16  1  0.528569  0.986737  0.717981  1
  Pd  Pd17  1  0.511649  0.648974  0.360944  1
  Pd  Pd18  1  0.518112  0.022953  0.289488  1
  Pd  Pd19  1  0.247285  0.618718  0.308603  1
  Pd  Pd20  1  0.289211  0.251546  0.361369  1
  Pd  Pd21  1  0.495420  0.833087  0.327495  1
  Pd  Pd22  1  0.249988  0.226433  0.265658  1
  Pd  Pd23  1  0.003846  0.035860  0.340232  1
  Pd  Pd24  1  0.713486  0.436084  0.283156  1
  Pd  Pd25  1  0.973578  0.799503  0.280359  1
  Pd  Pd26  1  0.839550  0.447383  0.339530  1
  Pd  Pd27  1  0.978294  0.850768  0.376582  1
  Pd  Pd28  1  0.764261  0.238856  0.312682  1
  Pd  Pd29  1  0.084046  0.869331  0.477184  1
  Pd  Pd30  1  0.801350  0.256658  0.410554  1
  Pd  Pd31  1  0.554928  0.871473  0.427600  1
  Pd  Pd32  1  0.128609  0.468910  0.491693  1
  Pd  Pd33  1  0.081836  0.072231  0.444265  1
  Pd  Pd34  1  0.320439  0.453700  0.389622  1
  Pd  Pd35  1  0.574745  0.264858  0.467346  1
  Pd  Pd36  1  0.057432  0.666693  0.411239  1
  Pd  Pd37  1  0.466556  0.049674  0.390491  1
  Pd  Pd38  1  0.571127  0.666795  0.460584  1
  Pd  Pd39  1  0.609809  0.062081  0.496521  1
  Pd  Pd40  1  0.857435  0.463678  0.438785  1
  Pd  Pd41  1  0.945150  0.069533  0.600418  1
  Pd  Pd42  1  0.429645  0.471337  0.544440  1
  Pd  Pd43  1  0.431034  0.069501  0.551050  1
  Pd  Pd44  1  0.536975  0.686645  0.621196  1
  Pd  Pd45  1  0.145761  0.272538  0.572948  1
  Pd  Pd46  1  0.393809  0.673905  0.515167  1
  Pd  Pd47  1  0.202026  0.479611  0.601174  1
  Pd  Pd48  1  0.918905  0.866739  0.534491  1
  Pd  Pd49  1  0.875208  0.267178  0.520058  1
  Pd  Pd50  1  0.448450  0.864836  0.584077  1
  Pd  Pd51  1  0.683317  0.282563  0.622097  1
  Pd  Pd52  1  0.922173  0.664060  0.567447  1
  Pd  Pd53  1  0.289508  0.300190  0.728549  1
  Pd  Pd54  1  0.999737  0.700428  0.671459  1
  Pd  Pd55  1  0.164740  0.288927  0.672169  1
  Pd  Pd56  1  0.029773  0.936828  0.731319  1
  Pd  Pd57  1  0.238984  0.497433  0.699024  1
  Pd  Pd58  1  0.025187  0.885525  0.635097  1
  Pd  Pd59  1  0.485133  0.713333  0.722207  1
  Pd  Pd60  1  0.491312  0.087275  0.650728  1
  Pd  Pd61  1  0.714228  0.484757  0.650342  1
  Pd  Pd62  1  0.756137  0.117594  0.703071  1
  Pd  Pd63  1  0.753217  0.509858  0.746046  1
  Pd  Pd64  1  0.508161  0.903191  0.684187  1
