# generated using pymatgen
data_HPd3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.82905928
_cell_length_b   7.93584681
_cell_length_c   53.11566128
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   71.97839182
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HPd3
_chemical_formula_sum   'H28 Pd84'
_cell_volume   3138.18486671
_cell_formula_units_Z   28
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  0.615247  0.320972  0.270551  1
  H  H2  1  0.824081  0.516582  0.272915  1
  H  H3  1  0.282131  0.830715  0.272171  1
  H  H4  1  0.375942  0.130626  0.276215  1
  H  H5  1  0.193328  0.074760  0.372836  1
  H  H6  1  0.538847  0.179427  0.318313  1
  H  H7  1  0.814161  0.609345  0.330948  1
  H  H8  1  0.021952  0.712491  0.262774  1
  H  H9  1  0.769981  0.755842  0.436702  1
  H  H10  1  -0.017687  0.913619  0.405019  1
  H  H11  1  0.382933  0.310111  0.396378  1
  H  H12  1  0.592860  0.466272  0.364666  1
  H  H13  1  0.347425  0.437590  0.500049  1
  H  H14  1  0.559452  0.595680  0.468388  1
  H  H15  1  0.961017  0.993549  0.459993  1
  H  H16  1  0.173045  0.151639  0.428333  1
  H  H17  1  0.927609  0.122957  0.563716  1
  H  H18  1  0.137537  0.279119  0.532003  1
  H  H19  1  0.538157  0.675611  0.523363  1
  H  H20  1  0.750489  0.833387  0.491679  1
  H  H21  1  0.498518  0.876739  0.665608  1
  H  H22  1  0.706308  0.979884  0.597434  1
  H  H23  1  -0.018377  0.409802  0.610068  1
  H  H24  1  0.327142  0.514469  0.555545  1
  H  H25  1  0.144528  0.458603  0.652166  1
  H  H26  1  0.238339  0.758514  0.656210  1
  H  H27  1  0.696389  0.072647  0.655467  1
  H  H28  1  0.905223  0.268257  0.657830  1
  Pd  Pd29  1  0.569149  0.550505  0.281891  1
  Pd  Pd30  1  0.818028  0.689152  0.255737  1
  Pd  Pd31  1  0.845079  0.311827  0.263293  1
  Pd  Pd32  1  0.671841  0.130035  0.291938  1
  Pd  Pd33  1  0.251629  0.672126  0.255681  1
  Pd  Pd34  1  0.071653  0.511100  0.284042  1
  Pd  Pd35  1  0.258625  0.770746  0.303976  1
  Pd  Pd36  1  0.453322  0.915143  0.269567  1
  Pd  Pd37  1  0.409858  0.299743  0.263008  1
  Pd  Pd38  1  0.170008  0.151925  0.290377  1
  Pd  Pd39  1  -0.012848  0.927450  0.271985  1
  Pd  Pd40  1  0.767780  0.764348  0.304086  1
  Pd  Pd41  1  0.145242  0.223520  0.343323  1
  Pd  Pd42  1  0.367315  0.380521  0.313479  1
  Pd  Pd43  1  0.453935  0.999228  0.321994  1
  Pd  Pd44  1  0.252314  0.859061  0.354849  1
  Pd  Pd45  1  0.854389  0.383538  0.313500  1
  Pd  Pd46  1  0.656166  0.233216  0.344155  1
  Pd  Pd47  1  0.847012  0.473002  0.364361  1
  Pd  Pd48  1  0.054863  0.617105  0.333873  1
  Pd  Pd49  1  0.957723  0.995447  0.323900  1
  Pd  Pd50  1  0.740704  0.838562  0.354401  1
  Pd  Pd51  1  0.551192  0.611941  0.334225  1
  Pd  Pd52  1  0.339178  0.454898  0.365322  1
  Pd  Pd53  1  0.722690  0.906743  0.406704  1
  Pd  Pd54  1  0.937389  0.066613  0.375705  1
  Pd  Pd55  1  0.043800  0.705681  0.385310  1
  Pd  Pd56  1  0.835622  0.548185  0.416868  1
  Pd  Pd57  1  0.443017  0.087376  0.374624  1
  Pd  Pd58  1  0.238603  0.931218  0.406371  1
  Pd  Pd59  1  0.428413  0.160684  0.426837  1
  Pd  Pd60  1  0.638151  0.317609  0.395584  1
  Pd  Pd61  1  0.529849  0.676383  0.385673  1
  Pd  Pd62  1  0.316702  0.517552  0.416940  1
  Pd  Pd63  1  0.125891  0.293711  0.395951  1
  Pd  Pd64  1  0.914337  0.134497  0.427871  1
  Pd  Pd65  1  0.301615  0.587746  0.469745  1
  Pd  Pd66  1  0.513475  0.746176  0.438393  1
  Pd  Pd67  1  0.624546  0.389570  0.448324  1
  Pd  Pd68  1  0.413768  0.231221  0.479962  1
  Pd  Pd69  1  0.027017  0.773329  0.437484  1
  Pd  Pd70  1  0.817784  0.613898  0.469154  1
  Pd  Pd71  1  0.006995  0.843053  0.489988  1
  Pd  Pd72  1  0.218855  1.001483  0.458637  1
  Pd  Pd73  1  0.106702  0.358008  0.448419  1
  Pd  Pd74  1  0.895924  0.199659  0.480057  1
  Pd  Pd75  1  0.702686  0.975331  0.459228  1
  Pd  Pd76  1  0.493453  0.815900  0.490898  1
  Pd  Pd77  1  0.882319  0.271620  0.532797  1
  Pd  Pd78  1  0.092057  0.428545  0.501545  1
  Pd  Pd79  1  0.203768  0.071677  0.511442  1
  Pd  Pd80  1  -0.009380  0.912846  0.542708  1
  Pd  Pd81  1  0.606132  0.454733  0.500510  1
  Pd  Pd82  1  0.394579  0.295518  0.532430  1
  Pd  Pd83  1  0.583080  0.522616  0.552676  1
  Pd  Pd84  1  0.797780  0.682486  0.521678  1
  Pd  Pd85  1  0.684847  1.041044  0.511513  1
  Pd  Pd86  1  0.476669  0.883548  0.543071  1
  Pd  Pd87  1  0.281866  0.658011  0.522011  1
  Pd  Pd88  1  0.077453  0.501853  0.553758  1
  Pd  Pd89  1  0.465606  0.972124  0.594508  1
  Pd  Pd90  1  0.673458  0.116227  0.564020  1
  Pd  Pd91  1  0.779765  0.750667  0.573981  1
  Pd  Pd92  1  0.562747  0.593782  0.604481  1
  Pd  Pd93  1  0.181291  0.134331  0.563059  1
  Pd  Pd94  1  0.969277  0.977288  0.594156  1
  Pd  Pd95  1  0.153155  0.208708  0.614902  1
  Pd  Pd96  1  0.375228  0.365709  0.585058  1
  Pd  Pd97  1  0.268156  0.730168  0.573532  1
  Pd  Pd98  1  0.066534  0.590001  0.606388  1
  Pd  Pd99  1  0.864304  0.356014  0.584226  1
  Pd  Pd100  1  0.666081  0.205691  0.614881  1
  Pd  Pd101  1  0.067148  0.674086  0.658815  1
  Pd  Pd102  1  0.261844  0.818483  0.624405  1
  Pd  Pd103  1  0.350462  0.437304  0.638005  1
  Pd  Pd104  1  0.110611  0.289486  0.665373  1
  Pd  Pd105  1  0.752690  0.824881  0.624295  1
  Pd  Pd106  1  0.533317  0.661779  0.656396  1
  Pd  Pd107  1  0.702441  0.900077  0.672645  1
  Pd  Pd108  1  0.951321  1.038724  0.646491  1
  Pd  Pd109  1  0.848628  0.459194  0.636443  1
  Pd  Pd110  1  0.675390  0.277402  0.665088  1
  Pd  Pd111  1  0.448816  0.078129  0.644339  1
  Pd  Pd112  1  0.268841  0.917103  0.672700  1
