# generated using pymatgen
data_HPd3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.57066524
_cell_length_b   11.23836260
_cell_length_c   48.57522937
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   103.67017871
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HPd3
_chemical_formula_sum   'H32 Pd96'
_cell_volume   3485.35520504
_cell_formula_units_Z   32
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  0.880899  0.048468  0.298265  1
  H  H2  1  0.973530  0.580629  0.300394  1
  H  H3  1  0.265990  0.750640  0.289049  1
  H  H4  1  0.588158  0.416177  0.285403  1
  H  H5  1  0.837026  0.870382  0.342082  1
  H  H6  1  0.947482  0.319718  0.295009  1
  H  H7  1  0.477286  0.680820  0.379130  1
  H  H8  1  0.312540  0.243472  0.301262  1
  H  H9  1  0.868019  0.831156  0.406912  1
  H  H10  1  0.827013  0.349191  0.376575  1
  H  H11  1  0.546683  0.640335  0.436899  1
  H  H12  1  0.504820  0.159763  0.406575  1
  H  H13  1  0.942571  0.792733  0.463979  1
  H  H14  1  0.901146  0.312209  0.434361  1
  H  H15  1  0.622463  0.602922  0.493607  1
  H  H16  1  0.581241  0.122306  0.464011  1
  H  H17  1  1.018245  0.755217  0.520673  1
  H  H18  1  0.977023  0.274601  0.491077  1
  H  H19  1  0.698340  0.565314  0.550323  1
  H  H20  1  0.656915  0.084790  0.520705  1
  H  H21  1  0.094667  0.717760  0.578109  1
  H  H22  1  0.052804  0.237188  0.547785  1
  H  H23  1  0.772473  0.528332  0.608109  1
  H  H24  1  0.731467  0.046367  0.577772  1
  H  H25  1  0.286946  0.634051  0.683422  1
  H  H26  1  0.122200  0.196703  0.605554  1
  H  H27  1  0.652004  0.557805  0.689675  1
  H  H28  1  0.762460  0.007141  0.642602  1
  H  H29  1  1.011328  0.461345  0.699281  1
  H  H30  1  0.333496  0.126883  0.695636  1
  H  H31  1  0.625956  0.296894  0.684290  1
  H  H32  1  0.718587  0.829055  0.686419  1
  Pd  Pd33  1  0.671808  0.047573  0.283947  1
  Pd  Pd34  1  0.708412  0.534091  0.303496  1
  Pd  Pd35  1  0.029983  0.956264  0.293581  1
  Pd  Pd36  1  0.053938  0.444246  0.315112  1
  Pd  Pd37  1  0.727515  0.774799  0.317071  1
  Pd  Pd38  1  0.697146  0.298763  0.289027  1
  Pd  Pd39  1  0.362897  0.632332  0.292751  1
  Pd  Pd40  1  0.388645  0.114699  0.316723  1
  Pd  Pd41  1  0.021750  0.709143  0.282294  1
  Pd  Pd42  1  0.040059  0.195798  0.302985  1
  Pd  Pd43  1  0.381308  0.868509  0.306170  1
  Pd  Pd44  1  0.338118  0.372498  0.281339  1
  Pd  Pd45  1  0.755793  0.008619  0.334971  1
  Pd  Pd46  1  0.785071  0.488224  0.359046  1
  Pd  Pd47  1  0.108909  0.918062  0.346832  1
  Pd  Pd48  1  0.129748  0.396707  0.371681  1
  Pd  Pd49  1  0.804916  0.731041  0.372729  1
  Pd  Pd50  1  0.768648  0.250849  0.344341  1
  Pd  Pd51  1  0.435990  0.584358  0.346878  1
  Pd  Pd52  1  0.469686  0.065874  0.372606  1
  Pd  Pd53  1  0.086818  0.676896  0.334450  1
  Pd  Pd54  1  0.120239  0.158099  0.358941  1
  Pd  Pd55  1  0.457037  0.822904  0.360266  1
  Pd  Pd56  1  0.415671  0.345162  0.333447  1
  Pd  Pd57  1  0.830383  0.967894  0.388423  1
  Pd  Pd58  1  0.864453  0.448131  0.414236  1
  Pd  Pd59  1  0.175823  0.875345  0.401799  1
  Pd  Pd60  1  0.207399  0.355940  0.427898  1
  Pd  Pd61  1  0.882478  0.689678  0.429350  1
  Pd  Pd62  1  0.841258  0.210026  0.400095  1
  Pd  Pd63  1  0.511061  0.543484  0.401770  1
  Pd  Pd64  1  0.544938  0.025211  0.428684  1
  Pd  Pd65  1  0.167854  0.636190  0.388583  1
  Pd  Pd66  1  0.201735  0.117809  0.414247  1
  Pd  Pd67  1  0.532611  0.782348  0.415584  1
  Pd  Pd68  1  0.493869  0.302586  0.387446  1
  Pd  Pd69  1  0.904841  0.928839  0.443502  1
  Pd  Pd70  1  0.939838  0.410213  0.470340  1
  Pd  Pd71  1  0.248688  0.835951  0.457758  1
  Pd  Pd72  1  0.282109  0.318030  0.484498  1
  Pd  Pd73  1  0.957687  0.651239  0.485886  1
  Pd  Pd74  1  0.917604  0.171178  0.456482  1
  Pd  Pd75  1  0.585176  0.504811  0.457983  1
  Pd  Pd76  1  0.620155  0.986784  0.485160  1
  Pd  Pd77  1  0.242387  0.596882  0.444008  1
  Pd  Pd78  1  0.276420  0.079196  0.470611  1
  Pd  Pd79  1  0.607436  0.744216  0.471745  1
  Pd  Pd80  1  0.566616  0.263836  0.442626  1
  Pd  Pd81  1  0.979331  0.890739  0.499524  1
  Pd  Pd82  1  1.014310  0.372711  0.526701  1
  Pd  Pd83  1  0.323066  0.798327  0.514074  1
  Pd  Pd84  1  0.357099  0.280641  0.540677  1
  Pd  Pd85  1  0.032870  0.613686  0.542058  1
  Pd  Pd86  1  0.992050  0.133307  0.512939  1
  Pd  Pd87  1  0.659648  0.467310  0.514344  1
  Pd  Pd88  1  0.694645  0.948683  0.541182  1
  Pd  Pd89  1  0.317377  0.559493  0.500187  1
  Pd  Pd90  1  0.350798  0.041571  0.526926  1
  Pd  Pd91  1  0.681882  0.706345  0.528202  1
  Pd  Pd92  1  0.641799  0.226284  0.498798  1
  Pd  Pd93  1  0.054548  0.852312  0.556000  1
  Pd  Pd94  1  0.088425  0.334039  0.582915  1
  Pd  Pd95  1  0.397751  0.759714  0.570437  1
  Pd  Pd96  1  0.431632  0.241332  0.596101  1
  Pd  Pd97  1  0.105617  0.574937  0.597238  1
  Pd  Pd98  1  0.066875  0.095175  0.569100  1
  Pd  Pd99  1  0.735033  0.429392  0.570448  1
  Pd  Pd100  1  0.769104  0.909629  0.596261  1
  Pd  Pd101  1  0.392088  0.521583  0.556786  1
  Pd  Pd102  1  0.423663  1.002178  0.582885  1
  Pd  Pd103  1  0.758228  0.667497  0.584589  1
  Pd  Pd104  1  0.717008  0.187845  0.555334  1
  Pd  Pd105  1  0.129800  0.811649  0.612078  1
  Pd  Pd106  1  0.163496  0.293165  0.637806  1
  Pd  Pd107  1  0.479247  0.719424  0.625743  1
  Pd  Pd108  1  0.512669  0.200627  0.650234  1
  Pd  Pd109  1  0.183816  0.532361  0.651237  1
  Pd  Pd110  1  0.142450  0.054618  0.624418  1
  Pd  Pd111  1  0.814415  0.389299  0.625639  1
  Pd  Pd112  1  0.843694  0.868904  0.649713  1
  Pd  Pd113  1  0.469738  0.480816  0.613003  1
  Pd  Pd114  1  0.490577  0.959460  0.637852  1
  Pd  Pd115  1  0.830838  0.626674  0.640343  1
  Pd  Pd116  1  0.794570  0.146482  0.611955  1
  Pd  Pd117  1  0.210841  0.762824  0.667962  1
  Pd  Pd118  1  0.236589  0.245190  0.691933  1
  Pd  Pd119  1  0.559427  0.681725  0.681699  1
  Pd  Pd120  1  0.577736  0.168379  0.702390  1
  Pd  Pd121  1  0.261368  0.505025  0.703345  1
  Pd  Pd122  1  0.218178  0.009014  0.678514  1
  Pd  Pd123  1  0.891075  0.343431  0.681188  1
  Pd  Pd124  1  0.927679  0.829950  0.700737  1
  Pd  Pd125  1  0.545549  0.433277  0.669572  1
  Pd  Pd126  1  0.569503  0.921259  0.691103  1
  Pd  Pd127  1  0.902341  0.578760  0.695658  1
  Pd  Pd128  1  0.871972  0.102724  0.667613  1
