# generated using pymatgen
data_HPd3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.91256498
_cell_length_b   9.34458217
_cell_length_c   48.87458101
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   113.99700867
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HPd3
_chemical_formula_sum   'H36 Pd108'
_cell_volume   4135.89247029
_cell_formula_units_Z   36
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  0.615678  0.490321  0.308312  1
  H  H2  1  0.246288  0.577411  0.293079  1
  H  H3  1  0.805362  0.822126  0.300995  1
  H  H4  1  0.429664  0.912053  0.292398  1
  H  H5  1  0.155558  0.796291  0.315063  1
  H  H6  1  0.731249  0.053237  0.290644  1
  H  H7  1  0.699100  0.108559  0.389428  1
  H  H8  1  0.326089  0.344185  0.297620  1
  H  H9  1  0.996606  0.237092  0.362421  1
  H  H10  1  0.570282  0.523893  0.374894  1
  H  H11  1  0.264336  0.396123  0.399284  1
  H  H12  1  0.874736  0.655632  0.342019  1
  H  H13  1  0.800072  0.708722  0.461375  1
  H  H14  1  0.399002  0.972168  0.413807  1
  H  H15  1  0.098070  0.840982  0.437059  1
  H  H16  1  0.666830  0.130968  0.448738  1
  H  H17  1  0.365866  0.999468  0.472935  1
  H  H18  1  0.966257  0.264293  0.423815  1
  H  H19  1  0.901966  0.313518  0.534338  1
  H  H20  1  0.500943  0.577025  0.485988  1
  H  H21  1  0.201097  0.445835  0.510170  1
  H  H22  1  0.768710  0.735446  0.521020  1
  H  H23  1  0.470116  0.605767  0.545355  1
  H  H24  1  0.066369  0.866845  0.496697  1
  H  H25  1  1.002048  0.914142  0.609386  1
  H  H26  1  0.602844  0.181749  0.558935  1
  H  H27  1  0.302638  0.052666  0.583710  1
  H  H28  1  0.868764  0.345833  0.594596  1
  H  H29  1  0.654708  0.316451  0.678633  1
  H  H30  1  0.170142  0.474575  0.569662  1
  H  H31  1  0.155013  0.548541  0.671138  1
  H  H32  1  0.712443  0.829461  0.677872  1
  H  H33  1  0.435038  0.687780  0.665369  1
  H  H34  1  0.018087  0.967738  0.674248  1
  H  H35  1  0.857281  0.642050  0.680706  1
  H  H36  1  0.361922  0.101786  0.672310  1
  Pd  Pd37  1  0.418200  0.533369  0.315978  1
  Pd  Pd38  1  0.091998  0.384518  0.336461  1
  Pd  Pd39  1  0.692250  0.650226  0.289781  1
  Pd  Pd40  1  0.500181  0.318669  0.294654  1
  Pd  Pd41  1  0.224222  0.189150  0.317641  1
  Pd  Pd42  1  0.928964  0.064291  0.340664  1
  Pd  Pd43  1  0.383334  0.731972  0.280127  1
  Pd  Pd44  1  0.095635  0.617276  0.300385  1
  Pd  Pd45  1  0.786897  0.478893  0.323120  1
  Pd  Pd46  1  0.338489  0.764446  0.334420  1
  Pd  Pd47  1  0.876050  0.992228  0.286584  1
  Pd  Pd48  1  0.628525  0.880017  0.313476  1
  Pd  Pd49  1  0.518409  0.090745  0.330431  1
  Pd  Pd50  1  0.192425  0.392107  0.284777  1
  Pd  Pd51  1  0.821444  0.228083  0.304398  1
  Pd  Pd52  1  0.570764  0.050557  0.278479  1
  Pd  Pd53  1  0.270264  0.945173  0.296057  1
  Pd  Pd54  1  0.968425  0.812306  0.318015  1
  Pd  Pd55  1  0.494939  0.120256  0.385273  1
  Pd  Pd56  1  0.199822  0.991401  0.408335  1
  Pd  Pd57  1  0.795753  0.253174  0.359771  1
  Pd  Pd58  1  0.634252  0.934464  0.367073  1
  Pd  Pd59  1  0.331708  0.800615  0.389854  1
  Pd  Pd60  1  0.036217  0.671309  0.413212  1
  Pd  Pd61  1  0.501445  0.353848  0.350327  1
  Pd  Pd62  1  0.196327  0.221168  0.372867  1
  Pd  Pd63  1  0.901609  0.091695  0.396816  1
  Pd  Pd64  1  0.460881  0.377295  0.405489  1
  Pd  Pd65  1  0.048269  0.635370  0.355961  1
  Pd  Pd66  1  0.763840  0.508178  0.381230  1
  Pd  Pd67  1  0.625628  0.694352  0.400636  1
  Pd  Pd68  1  0.222425  0.960876  0.352017  1
  Pd  Pd69  1  0.934651  0.835436  0.375360  1
  Pd  Pd70  1  0.680141  0.680322  0.346335  1
  Pd  Pd71  1  0.362047  0.542889  0.369664  1
  Pd  Pd72  1  0.063743  0.413035  0.392032  1
  Pd  Pd73  1  0.600843  0.724758  0.457055  1
  Pd  Pd74  1  0.301018  0.594351  0.481254  1
  Pd  Pd75  1  0.899325  0.856489  0.432009  1
  Pd  Pd76  1  0.736033  0.537066  0.437696  1
  Pd  Pd77  1  0.436405  0.406446  0.461979  1
  Pd  Pd78  1  0.137318  0.274969  0.485815  1
  Pd  Pd79  1  0.598799  0.955793  0.422048  1
  Pd  Pd80  1  0.299429  0.825671  0.445693  1
  Pd  Pd81  1  1.000455  0.693288  0.469466  1
  Pd  Pd82  1  0.565560  0.982772  0.477964  1
  Pd  Pd83  1  0.164285  0.248093  0.429035  1
  Pd  Pd84  1  0.865706  0.114349  0.453268  1
  Pd  Pd85  1  0.730729  0.302107  0.472373  1
  Pd  Pd86  1  0.326649  0.566247  0.424681  1
  Pd  Pd87  1  0.028311  0.434571  0.448103  1
  Pd  Pd88  1  0.763845  0.277643  0.416341  1
  Pd  Pd89  1  0.465122  0.147900  0.441078  1
  Pd  Pd90  1  0.164758  1.015737  0.464510  1
  Pd  Pd91  1  0.703287  0.329620  0.529042  1
  Pd  Pd92  1  0.405308  0.199747  0.553123  1
  Pd  Pd93  1  1.002279  0.462727  0.505231  1
  Pd  Pd94  1  0.838862  0.141764  0.510040  1
  Pd  Pd95  1  0.538582  1.009642  0.534394  1
  Pd  Pd96  1  0.241946  0.879460  0.558914  1
  Pd  Pd97  1  0.702291  0.560963  0.493824  1
  Pd  Pd98  1  0.402498  0.430077  0.517727  1
  Pd  Pd99  1  0.103309  0.299008  0.541640  1
  Pd  Pd100  1  0.669045  0.588087  0.550193  1
  Pd  Pd101  1  0.265520  0.851241  0.501992  1
  Pd  Pd102  1  0.968094  0.719718  0.526274  1
  Pd  Pd103  1  0.832814  0.905736  0.545118  1
  Pd  Pd104  1  0.430289  0.170573  0.496710  1
  Pd  Pd105  1  0.131677  0.039228  0.520494  1
  Pd  Pd106  1  0.866753  0.882942  0.488828  1
  Pd  Pd107  1  0.567602  0.751506  0.513334  1
  Pd  Pd108  1  0.268109  0.621216  0.537769  1
  Pd  Pd109  1  0.820216  0.941991  0.601110  1
  Pd  Pd110  1  0.533141  0.822317  0.624036  1
  Pd  Pd111  1  0.109001  0.068645  0.576440  1
  Pd  Pd112  1  0.944842  0.746914  0.583239  1
  Pd  Pd113  1  0.654958  0.619252  0.606212  1
  Pd  Pd114  1  0.364797  0.502174  0.628000  1
  Pd  Pd115  1  0.801530  0.163328  0.565488  1
  Pd  Pd116  1  0.502581  0.034908  0.589213  1
  Pd  Pd117  1  0.202794  0.904289  0.613930  1
  Pd  Pd118  1  0.769162  0.192132  0.620219  1
  Pd  Pd119  1  0.371454  0.458257  0.573626  1
  Pd  Pd120  1  0.067365  0.321632  0.597479  1
  Pd  Pd121  1  0.930021  0.509627  0.619241  1
  Pd  Pd122  1  0.535379  0.775989  0.569511  1
  Pd  Pd123  1  0.231034  0.641953  0.594282  1
  Pd  Pd124  1  0.966555  0.486811  0.562042  1
  Pd  Pd125  1  0.669164  0.356727  0.584646  1
  Pd  Pd126  1  0.368443  0.227486  0.608240  1
  Pd  Pd127  1  1.003737  0.598680  0.676475  1
  Pd  Pd128  1  0.712654  0.492912  0.691474  1
  Pd  Pd129  1  0.261749  0.718817  0.649244  1
  Pd  Pd130  1  0.079978  0.385910  0.650880  1
  Pd  Pd131  1  0.795988  0.267746  0.673449  1
  Pd  Pd132  1  0.508275  0.178632  0.691053  1
  Pd  Pd133  1  0.912227  0.767981  0.639086  1
  Pd  Pd134  1  0.608436  0.647456  0.660775  1
  Pd  Pd135  1  0.316771  0.534866  0.682408  1
  Pd  Pd136  1  0.872235  0.820683  0.690828  1
  Pd  Pd137  1  0.464777  0.054903  0.643672  1
  Pd  Pd138  1  0.187231  0.946635  0.672709  1
  Pd  Pd139  1  0.047967  0.142073  0.683366  1
  Pd  Pd140  1  0.631343  0.377132  0.641011  1
  Pd  Pd141  1  0.337687  0.267666  0.662654  1
  Pd  Pd142  1  0.075612  0.092880  0.631798  1
  Pd  Pd143  1  0.787048  0.981734  0.655865  1
  Pd  Pd144  1  0.523085  0.861051  0.680357  1
