# generated using pymatgen
data_HPd3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.71524875
_cell_length_b   7.55936557
_cell_length_c   54.54955230
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   110.65127651
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HPd3
_chemical_formula_sum   'H24 Pd72'
_cell_volume   2591.16951418
_cell_formula_units_Z   24
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  0.224969  0.919295  0.216233  1
  H  H2  1  0.713580  0.083755  0.262397  1
  H  H3  1  0.880825  0.340859  0.225592  1
  H  H4  1  0.256690  0.291785  0.221837  1
  H  H5  1  1.050615  0.325408  0.319101  1
  H  H6  1  0.338107  0.441793  0.360033  1
  H  H7  1  0.571941  0.494720  0.251381  1
  H  H8  1  0.827895  0.607683  0.298082  1
  H  H9  1  0.618488  0.568693  0.400149  1
  H  H10  1  0.900011  0.695338  0.439615  1
  H  H11  1  0.122581  0.730309  0.337556  1
  H  H12  1  0.411100  0.848183  0.376936  1
  H  H13  1  0.184828  0.819443  0.478840  1
  H  H14  1  0.473346  0.937317  0.518220  1
  H  H15  1  0.695916  0.972289  0.416161  1
  H  H16  1  0.977440  0.098934  0.455626  1
  H  H17  1  0.768032  0.059943  0.557694  1
  H  H18  1  1.023987  0.172907  0.604395  1
  H  H19  1  0.257821  0.225834  0.495743  1
  H  H20  1  0.545313  0.342219  0.536675  1
  H  H21  1  0.339237  0.375842  0.633938  1
  H  H22  1  0.715102  0.326768  0.630184  1
  H  H23  1  0.882348  0.583872  0.593379  1
  H  H24  1  0.370959  0.748332  0.639542  1
  Pd  Pd25  1  0.967870  0.817249  0.214836  1
  Pd  Pd26  1  0.239877  0.922273  0.251284  1
  Pd  Pd27  1  0.688065  0.288317  0.247891  1
  Pd  Pd28  1  0.375551  0.151133  0.212067  1
  Pd  Pd29  1  0.662716  0.927785  0.238760  1
  Pd  Pd30  1  0.353256  0.790020  0.208320  1
  Pd  Pd31  1  0.542880  0.539627  0.222614  1
  Pd  Pd32  1  0.822855  0.671961  0.262176  1
  Pd  Pd33  1  0.275626  0.295755  0.255482  1
  Pd  Pd34  1  0.990377  0.194923  0.216134  1
  Pd  Pd35  1  0.401976  0.661461  0.269714  1
  Pd  Pd36  1  0.081314  0.530586  0.234695  1
  Pd  Pd37  1  0.526945  0.040057  0.286819  1
  Pd  Pd38  1  0.802218  0.158107  0.324773  1
  Pd  Pd39  1  0.283168  0.531767  0.326048  1
  Pd  Pd40  1  0.989757  0.413049  0.287340  1
  Pd  Pd41  1  0.211865  0.161250  0.314866  1
  Pd  Pd42  1  0.933820  0.042377  0.276403  1
  Pd  Pd43  1  0.118600  0.789664  0.300385  1
  Pd  Pd44  1  0.402986  0.909585  0.338885  1
  Pd  Pd45  1  0.857381  0.529991  0.332936  1
  Pd  Pd46  1  0.564705  0.411766  0.294333  1
  Pd  Pd47  1  0.975431  0.895560  0.348181  1
  Pd  Pd48  1  0.687537  0.778394  0.309444  1
  Pd  Pd49  1  1.079596  0.274243  0.362595  1
  Pd  Pd50  1  0.356652  0.393045  0.401057  1
  Pd  Pd51  1  0.867560  0.775048  0.404945  1
  Pd  Pd52  1  0.575274  0.651978  0.365625  1
  Pd  Pd53  1  0.771740  0.404610  0.391376  1
  Pd  Pd54  1  0.493717  0.281635  0.352843  1
  Pd  Pd55  1  0.685280  0.028960  0.377633  1
  Pd  Pd56  1  0.964474  0.151689  0.416177  1
  Pd  Pd57  1  0.439062  0.767823  0.411761  1
  Pd  Pd58  1  0.150357  0.647243  0.372341  1
  Pd  Pd59  1  0.546107  0.139622  0.425521  1
  Pd  Pd60  1  0.263227  0.016604  0.386708  1
  Pd  Pd61  1  0.631453  0.515938  0.439599  1
  Pd  Pd62  1  0.910648  0.638666  0.478143  1
  Pd  Pd63  1  0.445570  0.020384  0.483435  1
  Pd  Pd64  1  0.156865  0.899803  0.444015  1
  Pd  Pd65  1  0.332701  0.651023  0.469068  1
  Pd  Pd66  1  1.049820  0.528005  0.430255  1
  Pd  Pd67  1  0.239276  0.274581  0.454719  1
  Pd  Pd68  1  0.516332  0.393384  0.493181  1
  Pd  Pd69  1  1.020654  0.015649  0.490151  1
  Pd  Pd70  1  0.728368  0.892579  0.450831  1
  Pd  Pd71  1  0.102211  0.385992  0.502933  1
  Pd  Pd72  1  0.824188  0.263016  0.464400  1
  Pd  Pd73  1  0.192941  0.758041  0.516891  1
  Pd  Pd74  1  0.477328  0.877962  0.555391  1
  Pd  Pd75  1  1.031223  0.255861  0.561443  1
  Pd  Pd76  1  0.738547  0.137635  0.522840  1
  Pd  Pd77  1  0.908391  0.889232  0.546331  1
  Pd  Pd78  1  0.620497  0.772067  0.507595  1
  Pd  Pd79  1  0.793710  0.509520  0.531003  1
  Pd  Pd80  1  1.068982  0.627570  0.568956  1
  Pd  Pd81  1  0.606171  0.254578  0.568436  1
  Pd  Pd82  1  0.312760  0.135860  0.529728  1
  Pd  Pd83  1  0.662107  0.625250  0.579373  1
  Pd  Pd84  1  0.384063  0.506377  0.540910  1
  Pd  Pd85  1  0.773073  0.995666  0.593600  1
  Pd  Pd86  1  1.053048  0.128000  0.633162  1
  Pd  Pd87  1  0.605551  0.472704  0.639642  1
  Pd  Pd88  1  0.320302  0.371872  0.600293  1
  Pd  Pd89  1  0.514614  0.137040  0.621081  1
  Pd  Pd90  1  0.193952  0.006165  0.586062  1
  Pd  Pd91  1  0.356050  0.745354  0.604492  1
  Pd  Pd92  1  0.628058  0.850377  0.640940  1
  Pd  Pd93  1  0.220377  0.516494  0.643709  1
  Pd  Pd94  1  0.907863  0.379310  0.607885  1
  Pd  Pd95  1  0.242672  0.877607  0.647456  1
  Pd  Pd96  1  0.933211  0.739842  0.617016  1
