# generated using pymatgen
data_HPd3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   17.03755317
_cell_length_b   6.30030550
_cell_length_c   55.41395504
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   99.34629622
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HPd3
_chemical_formula_sum   'H54 Pd162'
_cell_volume   5869.26922777
_cell_formula_units_Z   54
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  0.876613  0.973551  0.237281  1
  H  H2  1  0.284833  0.830133  0.244257  1
  H  H3  1  0.533594  0.926245  0.254532  1
  H  H4  1  0.836150  0.495234  0.240603  1
  H  H5  1  0.321869  0.325272  0.242666  1
  H  H6  1  0.650785  0.275836  0.245250  1
  H  H7  1  0.851020  0.892306  0.279655  1
  H  H8  1  0.155274  0.484609  0.255373  1
  H  H9  1  0.491206  0.831174  0.312360  1
  H  H10  1  0.977054  0.289034  0.260385  1
  H  H11  1  0.277414  0.224283  0.284602  1
  H  H12  1  0.614887  0.202377  0.301688  1
  H  H13  1  0.814973  0.787933  0.330335  1
  H  H14  1  0.133539  0.753101  0.345480  1
  H  H15  1  0.456435  0.710336  0.363600  1
  H  H16  1  0.939707  0.169655  0.317363  1
  H  H17  1  0.257393  0.129154  0.336149  1
  H  H18  1  0.579902  0.089035  0.353410  1
  H  H19  1  0.779711  0.669396  0.379962  1
  H  H20  1  0.100775  0.630117  0.396191  1
  H  H21  1  0.422236  0.589246  0.413807  1
  H  H22  1  0.902716  1.051538  0.368917  1
  H  H23  1  0.223040  1.010410  0.385905  1
  H  H24  1  0.545001  0.969659  0.403221  1
  H  H25  1  0.744799  0.550198  0.429803  1
  H  H26  1  0.066747  0.510375  0.446263  1
  H  H27  1  0.388114  0.469575  0.463873  1
  H  H28  1  0.867993  0.931623  0.419115  1
  H  H29  1  0.189148  0.891824  0.435709  1
  H  H30  1  0.510764  0.850483  0.453188  1
  H  H31  1  0.710053  0.430617  0.479705  1
  H  H32  1  0.033090  0.391469  0.496230  1
  H  H33  1  0.354068  0.349991  0.514199  1
  H  H34  1  0.833262  0.811821  0.469025  1
  H  H35  1  0.155361  0.773387  0.485654  1
  H  H36  1  0.476432  0.730761  0.503188  1
  H  H37  1  0.674949  0.310746  0.529695  1
  H  H38  1  -0.001329  0.271376  0.546073  1
  H  H39  1  0.321169  0.229951  0.565323  1
  H  H40  1  0.798404  0.691312  0.518955  1
  H  H41  1  0.121138  0.653993  0.535645  1
  H  H42  1  0.442081  0.611548  0.553140  1
  H  H43  1  0.639236  0.193720  0.581061  1
  H  H44  1  0.971069  0.157227  0.598852  1
  H  H45  1  0.281302  0.110258  0.621929  1
  H  H46  1  0.762998  0.570572  0.569206  1
  H  H47  1  0.084783  0.544305  0.587127  1
  H  H48  1  0.415458  0.501751  0.604961  1
  H  H49  1  0.603028  0.102701  0.638101  1
  H  H50  1  0.907708  0.120943  0.644970  1
  H  H51  1  0.324176  0.790859  0.644902  1
  H  H52  1  0.718398  0.525513  0.644179  1
  H  H53  1  0.043514  0.456260  0.644035  1
  H  H54  1  0.377590  0.407850  0.647618  1
  Pd  Pd55  1  0.786839  0.981166  0.253016  1
  Pd  Pd56  1  0.108829  0.944170  0.269174  1
  Pd  Pd57  1  0.466823  1.024106  0.240182  1
  Pd  Pd58  1  0.864662  0.726079  0.229006  1
  Pd  Pd59  1  0.191629  0.704604  0.241734  1
  Pd  Pd60  1  0.506217  0.651055  0.256165  1
  Pd  Pd61  1  0.953326  0.968678  0.260188  1
  Pd  Pd62  1  0.312708  1.069909  0.233277  1
  Pd  Pd63  1  0.627142  0.992868  0.244452  1
  Pd  Pd64  1  0.068884  0.333201  0.249534  1
  Pd  Pd65  1  0.390640  0.296577  0.267745  1
  Pd  Pd66  1  0.742685  0.371252  0.235875  1
  Pd  Pd67  1  0.990078  0.579002  0.276857  1
  Pd  Pd68  1  0.345542  0.636990  0.245047  1
  Pd  Pd69  1  0.668944  0.624125  0.265161  1
  Pd  Pd70  1  0.904130  0.322215  0.240781  1
  Pd  Pd71  1  0.225617  0.304781  0.257553  1
  Pd  Pd72  1  0.582629  0.376543  0.233015  1
  Pd  Pd73  1  0.753938  0.867064  0.302399  1
  Pd  Pd74  1  0.074608  0.826353  0.317597  1
  Pd  Pd75  1  0.428159  0.899606  0.286216  1
  Pd  Pd76  1  0.828485  0.597848  0.273646  1
  Pd  Pd77  1  0.149059  0.566606  0.288010  1
  Pd  Pd78  1  0.472557  0.533374  0.305459  1
  Pd  Pd79  1  0.915385  0.848086  0.309198  1
  Pd  Pd80  1  0.271719  0.927215  0.278252  1
  Pd  Pd81  1  0.589497  0.884103  0.293615  1
  Pd  Pd82  1  0.032599  0.211737  0.298662  1
  Pd  Pd83  1  0.351594  0.172201  0.315724  1
  Pd  Pd84  1  0.706863  0.241856  0.282937  1
  Pd  Pd85  1  0.956261  0.466549  0.327670  1
  Pd  Pd86  1  0.308350  0.543587  0.295531  1
  Pd  Pd87  1  0.633262  0.504859  0.313231  1
  Pd  Pd88  1  0.872474  0.219927  0.290177  1
  Pd  Pd89  1  0.192527  0.187896  0.306704  1
  Pd  Pd90  1  0.548327  0.259062  0.277266  1
  Pd  Pd91  1  0.718766  0.747352  0.351785  1
  Pd  Pd92  1  0.040836  0.708715  0.367210  1
  Pd  Pd93  1  0.394623  0.785027  0.335186  1
  Pd  Pd94  1  0.794227  0.488507  0.321765  1
  Pd  Pd95  1  0.116367  0.454615  0.337132  1
  Pd  Pd96  1  0.437076  0.413137  0.354783  1
  Pd  Pd97  1  0.879056  0.729678  0.359184  1
  Pd  Pd98  1  0.233379  0.810527  0.326694  1
  Pd  Pd99  1  0.555761  0.768493  0.343632  1
  Pd  Pd100  1  -0.002706  0.092323  0.347765  1
  Pd  Pd101  1  0.317494  1.051703  0.365095  1
  Pd  Pd102  1  0.673544  0.127984  0.332297  1
  Pd  Pd103  1  0.921307  0.346461  0.378146  1
  Pd  Pd104  1  0.275628  0.425343  0.345337  1
  Pd  Pd105  1  0.598196  0.384087  0.362724  1
  Pd  Pd106  1  0.837973  0.107790  0.340102  1
  Pd  Pd107  1  0.158099  1.069497  0.356210  1
  Pd  Pd108  1  0.512916  0.143949  0.324836  1
  Pd  Pd109  1  0.684194  0.627931  0.401409  1
  Pd  Pd110  1  0.006562  0.589358  0.417308  1
  Pd  Pd111  1  0.361574  0.667648  0.384897  1
  Pd  Pd112  1  0.759915  0.372338  0.371073  1
  Pd  Pd113  1  0.082109  0.335160  0.386969  1
  Pd  Pd114  1  0.403245  0.294215  0.404519  1
  Pd  Pd115  1  0.844288  0.610900  0.409129  1
  Pd  Pd116  1  0.199870  0.691406  0.375939  1
  Pd  Pd117  1  0.521508  0.649678  0.393317  1
  Pd  Pd118  1  0.962437  0.972602  0.397759  1
  Pd  Pd119  1  0.283682  0.932512  0.414947  1
  Pd  Pd120  1  0.639732  1.010763  0.382133  1
  Pd  Pd121  1  0.886715  0.226784  0.428187  1
  Pd  Pd122  1  0.242130  0.305971  0.395207  1
  Pd  Pd123  1  0.563955  0.265306  0.412494  1
  Pd  Pd124  1  0.802784  0.989328  0.389913  1
  Pd  Pd125  1  0.124241  0.950226  0.406287  1
  Pd  Pd126  1  0.479440  1.027587  0.374143  1
  Pd  Pd127  1  0.649826  0.508749  0.451212  1
  Pd  Pd128  1  0.972400  0.470007  0.467190  1
  Pd  Pd129  1  0.327733  0.548586  0.434737  1
  Pd  Pd130  1  0.725669  0.254244  0.420800  1
  Pd  Pd131  1  0.047939  0.215634  0.436930  1
  Pd  Pd132  1  0.369308  0.175219  0.454370  1
  Pd  Pd133  1  0.809880  0.491780  0.458999  1
  Pd  Pd134  1  0.165970  0.571715  0.425827  1
  Pd  Pd135  1  0.487374  0.530791  0.443197  1
  Pd  Pd136  1  0.928129  0.853259  0.447710  1
  Pd  Pd137  1  0.249719  0.813632  0.464823  1
  Pd  Pd138  1  0.605466  0.891656  0.431933  1
  Pd  Pd139  1  0.852472  0.107798  0.478038  1
  Pd  Pd140  1  0.208229  0.186865  0.445176  1
  Pd  Pd141  1  0.529724  0.146035  0.462341  1
  Pd  Pd142  1  0.768210  0.870183  0.439770  1
  Pd  Pd143  1  0.090245  0.831019  0.456278  1
  Pd  Pd144  1  0.445584  0.909034  0.423846  1
  Pd  Pd145  1  0.615445  0.389186  0.501077  1
  Pd  Pd146  1  0.938526  0.351653  0.516988  1
  Pd  Pd147  1  0.293802  0.429596  0.484623  1
  Pd  Pd148  1  0.691315  0.135090  0.470641  1
  Pd  Pd149  1  0.013884  0.096526  0.486847  1
  Pd  Pd150  1  0.335347  1.056728  0.504290  1
  Pd  Pd151  1  0.775514  0.372644  0.508827  1
  Pd  Pd152  1  0.131933  0.452416  0.475744  1
  Pd  Pd153  1  0.453249  0.411759  0.493188  1
  Pd  Pd154  1  0.893869  0.733709  0.497477  1
  Pd  Pd155  1  0.215833  0.695240  0.514567  1
  Pd  Pd156  1  0.571149  0.772491  0.481867  1
  Pd  Pd157  1  0.818280  0.989164  0.527588  1
  Pd  Pd158  1  0.174245  1.068530  0.495117  1
  Pd  Pd159  1  0.495374  1.026647  0.512261  1
  Pd  Pd160  1  0.733739  0.750900  0.489602  1
  Pd  Pd161  1  0.056208  0.711681  0.506142  1
  Pd  Pd162  1  0.411451  0.789994  0.473702  1
  Pd  Pd163  1  0.581017  0.269114  0.550942  1
  Pd  Pd164  1  0.904440  0.233373  0.566182  1
  Pd  Pd165  1  0.259879  0.311536  0.534508  1
  Pd  Pd166  1  0.656916  1.015536  0.520639  1
  Pd  Pd167  1  0.979555  0.976214  0.536559  1
  Pd  Pd168  1  0.302008  0.939086  0.554061  1
  Pd  Pd169  1  0.741249  0.254393  0.558565  1
  Pd  Pd170  1  0.097798  0.333906  0.525792  1
  Pd  Pd171  1  0.419254  0.293335  0.543394  1
  Pd  Pd172  1  0.859573  0.614660  0.547152  1
  Pd  Pd173  1  0.182234  0.580472  0.564107  1
  Pd  Pd174  1  0.536987  0.653209  0.531973  1
  Pd  Pd175  1  0.783771  0.872050  0.576550  1
  Pd  Pd176  1  0.140004  0.950550  0.544860  1
  Pd  Pd177  1  0.461305  0.907206  0.562195  1
  Pd  Pd178  1  0.699188  0.631249  0.539422  1
  Pd  Pd179  1  0.022409  0.593967  0.556222  1
  Pd  Pd180  1  0.377378  0.670584  0.523640  1
  Pd  Pd181  1  0.546754  0.148967  0.600166  1
  Pd  Pd182  1  0.867801  0.118646  0.614140  1
  Pd  Pd183  1  0.224575  0.189600  0.583798  1
  Pd  Pd184  1  0.622893  0.895257  0.570926  1
  Pd  Pd185  1  0.944599  0.854294  0.586420  1
  Pd  Pd186  1  0.268873  0.824663  0.603845  1
  Pd  Pd187  1  0.706002  0.141350  0.607719  1
  Pd  Pd188  1  0.062278  0.211731  0.575751  1
  Pd  Pd189  1  0.385616  0.175927  0.593793  1
  Pd  Pd190  1  0.826327  0.497323  0.596262  1
  Pd  Pd191  1  0.146399  0.462810  0.611522  1
  Pd  Pd192  1  0.502864  0.534855  0.582367  1
  Pd  Pd193  1  0.749788  0.759301  0.623071  1
  Pd  Pd194  1  0.105549  0.837382  0.595162  1
  Pd  Pd195  1  0.425495  0.793569  0.611645  1
  Pd  Pd196  1  0.663995  0.509620  0.588724  1
  Pd  Pd197  1  0.987499  0.475994  0.605753  1
  Pd  Pd198  1  0.342807  0.550117  0.573663  1
  Pd  Pd199  1  0.513215  1.024620  0.647293  1
  Pd  Pd200  1  0.835663  1.001992  0.659540  1
  Pd  Pd201  1  0.188114  1.076848  0.632884  1
  Pd  Pd202  1  0.589777  0.775877  0.620422  1
  Pd  Pd203  1  0.907457  0.739143  0.635237  1
  Pd  Pd204  1  0.230077  0.703472  0.649196  1
  Pd  Pd205  1  0.673312  1.031551  0.654024  1
  Pd  Pd206  1  0.021763  0.092170  0.625282  1
  Pd  Pd207  1  0.346823  1.076062  0.644772  1
  Pd  Pd208  1  0.791591  0.379710  0.644479  1
  Pd  Pd209  1  0.110240  0.349312  0.656045  1
  Pd  Pd210  1  0.468337  0.417440  0.631876  1
  Pd  Pd211  1  0.716709  0.656194  0.666755  1
  Pd  Pd212  1  0.065940  0.723578  0.643026  1
  Pd  Pd213  1  0.383949  0.654077  0.656966  1
  Pd  Pd214  1  0.625137  0.394722  0.638041  1
  Pd  Pd215  1  0.950441  0.361339  0.653186  1
  Pd  Pd216  1  0.303830  0.425866  0.622581  1
