# generated using pymatgen
data_HPd3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.53830067
_cell_length_b   18.90859477
_cell_length_c   51.13061471
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   88.66104939
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HPd3
_chemical_formula_sum   'H48 Pd144'
_cell_volume   5353.01179535
_cell_formula_units_Z   48
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  0.900842  0.189963  0.281438  1
  H  H2  1  0.562524  0.497561  0.287755  1
  H  H3  1  0.173756  0.902715  0.285808  1
  H  H4  1  0.112354  0.045636  0.283852  1
  H  H5  1  0.165554  0.302861  0.292842  1
  H  H6  1  0.743189  0.624000  0.272437  1
  H  H7  1  0.947951  0.174664  0.330528  1
  H  H8  1  0.641228  0.510553  0.348558  1
  H  H9  1  0.915571  0.742909  0.289674  1
  H  H10  1  0.687096  0.875595  0.298362  1
  H  H11  1  0.184816  0.299011  0.355588  1
  H  H12  1  0.844308  0.624322  0.318934  1
  H  H13  1  0.976446  0.177484  0.387575  1
  H  H14  1  0.667023  0.513584  0.406427  1
  H  H15  1  0.297755  0.847190  0.366165  1
  H  H16  1  0.552267  0.965952  0.391553  1
  H  H17  1  0.230754  0.298926  0.412252  1
  H  H18  1  0.870896  0.633101  0.375698  1
  H  H19  1  0.023669  0.179615  0.442949  1
  H  H20  1  0.709872  0.514631  0.462407  1
  H  H21  1  0.342407  0.847489  0.423115  1
  H  H22  1  0.593240  0.966568  0.448436  1
  H  H23  1  0.275969  0.300803  0.467672  1
  H  H24  1  0.915587  0.634098  0.431268  1
  H  H25  1  0.068987  0.180915  0.498364  1
  H  H26  1  0.753689  0.516070  0.518382  1
  H  H27  1  0.387894  0.848166  0.479502  1
  H  H28  1  0.638171  0.967304  0.504661  1
  H  H29  1  0.320024  0.302462  0.522915  1
  H  H30  1  0.959513  0.634880  0.487178  1
  H  H31  1  0.115406  0.182256  0.553828  1
  H  H32  1  0.796656  0.517665  0.574762  1
  H  H33  1  0.433657  0.849058  0.535924  1
  H  H34  1  0.684818  0.968584  0.560647  1
  H  H35  1  0.367594  0.304724  0.577777  1
  H  H36  1  0.002877  0.635662  0.543431  1
  H  H37  1  0.166536  0.181404  0.610877  1
  H  H38  1  0.831171  0.521055  0.635517  1
  H  H39  1  0.480160  0.849034  0.593146  1
  H  H40  1  0.693509  0.967608  0.620634  1
  H  H41  1  0.411045  0.303882  0.633971  1
  H  H42  1  0.047131  0.634462  0.601136  1
  H  H43  1  0.206652  0.184864  0.673299  1
  H  H44  1  0.818441  0.490009  0.685446  1
  H  H45  1  0.538942  0.851837  0.656052  1
  H  H46  1  0.862906  0.976587  0.670559  1
  H  H47  1  0.449363  0.308630  0.682778  1
  H  H48  1  0.006033  0.612774  0.676589  1
  Pd  Pd49  1  0.669935  0.181256  0.308688  1
  Pd  Pd50  1  0.291525  0.507888  0.277182  1
  Pd  Pd51  1  0.950034  0.835839  0.288495  1
  Pd  Pd52  1  0.907453  0.104647  0.274852  1
  Pd  Pd53  1  0.635495  0.408268  0.295192  1
  Pd  Pd54  1  0.705838  0.716524  0.270595  1
  Pd  Pd55  1  0.184280  0.183520  0.303590  1
  Pd  Pd56  1  0.767145  0.533043  0.269576  1
  Pd  Pd57  1  0.442716  0.860365  0.282432  1
  Pd  Pd58  1  0.721899  0.962485  0.307495  1
  Pd  Pd59  1  0.410575  0.287461  0.277872  1
  Pd  Pd60  1  0.041201  0.635063  0.289626  1
  Pd  Pd61  1  0.404211  0.061607  0.285323  1
  Pd  Pd62  1  0.126145  0.393256  0.301243  1
  Pd  Pd63  1  0.777656  0.732910  0.322446  1
  Pd  Pd64  1  0.053429  0.969342  0.270440  1
  Pd  Pd65  1  0.910566  0.278549  0.278503  1
  Pd  Pd66  1  0.526821  0.619418  0.300236  1
  Pd  Pd67  1  0.714651  0.177758  0.362746  1
  Pd  Pd68  1  0.367372  0.505127  0.328559  1
  Pd  Pd69  1  0.021564  0.846353  0.344507  1
  Pd  Pd70  1  0.965414  0.074722  0.329960  1
  Pd  Pd71  1  0.667639  0.408751  0.350800  1
  Pd  Pd72  1  0.277539  0.745899  0.311938  1
  Pd  Pd73  1  0.212275  0.186026  0.357120  1
  Pd  Pd74  1  0.871735  0.516760  0.320845  1
  Pd  Pd75  1  0.529394  0.853708  0.337191  1
  Pd  Pd76  1  0.766583  0.966486  0.362097  1
  Pd  Pd77  1  0.418028  0.299912  0.329011  1
  Pd  Pd78  1  0.092390  0.631354  0.344405  1
  Pd  Pd79  1  0.463017  0.068040  0.338473  1
  Pd  Pd80  1  0.156364  0.399256  0.357646  1
  Pd  Pd81  1  0.827757  0.733621  0.376522  1
  Pd  Pd82  1  0.222669  0.954981  0.317095  1
  Pd  Pd83  1  0.918004  0.289623  0.332493  1
  Pd  Pd84  1  0.593202  0.621183  0.352708  1
  Pd  Pd85  1  0.757692  0.178266  0.418377  1
  Pd  Pd86  1  0.402073  0.510743  0.383159  1
  Pd  Pd87  1  0.074198  0.845989  0.399587  1
  Pd  Pd88  1  0.013207  0.076878  0.386305  1
  Pd  Pd89  1  0.702971  0.411089  0.406467  1
  Pd  Pd90  1  0.329653  0.746526  0.367585  1
  Pd  Pd91  1  0.256676  0.186887  0.412236  1
  Pd  Pd92  1  0.901374  0.520156  0.375910  1
  Pd  Pd93  1  0.573121  0.855798  0.392478  1
  Pd  Pd94  1  0.812628  0.966865  0.417382  1
  Pd  Pd95  1  0.455544  0.298550  0.382674  1
  Pd  Pd96  1  0.136967  0.633992  0.399779  1
  Pd  Pd97  1  0.509386  0.066297  0.393482  1
  Pd  Pd98  1  0.197414  0.400480  0.413234  1
  Pd  Pd99  1  0.876207  0.734872  0.431485  1
  Pd  Pd100  1  0.268083  0.956060  0.369921  1
  Pd  Pd101  1  0.955919  0.289802  0.388155  1
  Pd  Pd102  1  0.637499  0.624124  0.407463  1
  Pd  Pd103  1  0.802685  0.179759  0.473869  1
  Pd  Pd104  1  0.444248  0.513094  0.438127  1
  Pd  Pd105  1  0.121278  0.846631  0.455350  1
  Pd  Pd106  1  0.059042  0.078277  0.442286  1
  Pd  Pd107  1  0.746120  0.413093  0.461711  1
  Pd  Pd108  1  0.380144  0.746799  0.423576  1
  Pd  Pd109  1  0.301703  0.188750  0.467447  1
  Pd  Pd110  1  0.943602  0.522458  0.430994  1
  Pd  Pd111  1  0.620215  0.856333  0.448450  1
  Pd  Pd112  1  0.858924  0.967773  0.473164  1
  Pd  Pd113  1  0.498339  0.299964  0.437303  1
  Pd  Pd114  1  0.181353  0.635419  0.455318  1
  Pd  Pd115  1  0.554884  0.067359  0.449251  1
  Pd  Pd116  1  0.241310  0.402292  0.468419  1
  Pd  Pd117  1  0.921445  0.735902  0.486920  1
  Pd  Pd118  1  0.314149  0.957344  0.424664  1
  Pd  Pd119  1  -0.001148  0.291124  0.443534  1
  Pd  Pd120  1  0.682103  0.625655  0.462582  1
  Pd  Pd121  1  0.848056  0.181229  0.528964  1
  Pd  Pd122  1  0.488569  0.514933  0.493501  1
  Pd  Pd123  1  0.167263  0.847418  0.511081  1
  Pd  Pd124  1  0.105414  0.079633  0.497866  1
  Pd  Pd125  1  0.790415  0.415049  0.517034  1
  Pd  Pd126  1  0.426023  0.747448  0.479558  1
  Pd  Pd127  1  0.346828  0.190466  0.522648  1
  Pd  Pd128  1  0.987818  0.524151  0.486265  1
  Pd  Pd129  1  0.666115  0.857061  0.504402  1
  Pd  Pd130  1  0.904704  0.968706  0.528623  1
  Pd  Pd131  1  0.542597  0.301852  0.492274  1
  Pd  Pd132  1  0.225886  0.636775  0.510983  1
  Pd  Pd133  1  0.600701  0.068494  0.504910  1
  Pd  Pd134  1  0.286343  0.404297  0.523589  1
  Pd  Pd135  1  0.965978  0.737148  0.542531  1
  Pd  Pd136  1  0.360190  0.958208  0.480319  1
  Pd  Pd137  1  0.043253  0.293114  0.498762  1
  Pd  Pd138  1  0.726661  0.627015  0.518019  1
  Pd  Pd139  1  0.893985  0.181974  0.583512  1
  Pd  Pd140  1  0.533850  0.517082  0.549346  1
  Pd  Pd141  1  0.212252  0.848227  0.566629  1
  Pd  Pd142  1  0.151318  0.080775  0.553225  1
  Pd  Pd143  1  0.835044  0.416933  0.572299  1
  Pd  Pd144  1  0.471520  0.748315  0.535540  1
  Pd  Pd145  1  0.392311  0.191710  0.577828  1
  Pd  Pd146  1  0.032713  0.525978  0.541553  1
  Pd  Pd147  1  0.710469  0.857964  0.560453  1
  Pd  Pd148  1  0.949569  0.970290  0.583458  1
  Pd  Pd149  1  0.587730  0.303397  0.547365  1
  Pd  Pd150  1  0.269983  0.638698  0.566670  1
  Pd  Pd151  1  0.645626  0.069842  0.560367  1
  Pd  Pd152  1  0.332942  0.405958  0.578621  1
  Pd  Pd153  1  0.009874  0.739022  0.598411  1
  Pd  Pd154  1  0.406242  0.959098  0.536095  1
  Pd  Pd155  1  0.088414  0.295001  0.553787  1
  Pd  Pd156  1  0.770607  0.628976  0.573672  1
  Pd  Pd157  1  0.935717  0.181899  0.636994  1
  Pd  Pd158  1  0.580507  0.519732  0.605951  1
  Pd  Pd159  1  0.253576  0.852880  0.621112  1
  Pd  Pd160  1  0.197113  0.082275  0.608938  1
  Pd  Pd161  1  0.879042  0.416348  0.627230  1
  Pd  Pd162  1  0.516178  0.749543  0.591926  1
  Pd  Pd163  1  0.438953  0.194054  0.633070  1
  Pd  Pd164  1  0.078176  0.527828  0.596323  1
  Pd  Pd165  1  0.753868  0.858784  0.616996  1
  Pd  Pd166  1  0.990279  0.973253  0.636778  1
  Pd  Pd167  1  0.635496  0.303756  0.602508  1
  Pd  Pd168  1  0.317089  0.641520  0.621738  1
  Pd  Pd169  1  0.684685  0.072206  0.616355  1
  Pd  Pd170  1  0.382739  0.407009  0.633103  1
  Pd  Pd171  1  0.027697  0.752383  0.651619  1
  Pd  Pd172  1  0.453507  0.960885  0.592050  1
  Pd  Pd173  1  0.135273  0.295964  0.608578  1
  Pd  Pd174  1  0.821039  0.629676  0.628934  1
  Pd  Pd175  1  0.953140  0.195091  0.687199  1
  Pd  Pd176  1  0.620208  0.523301  0.662587  1
  Pd  Pd177  1  0.306060  0.849341  0.674222  1
  Pd  Pd178  1  0.253967  0.094895  0.664244  1
  Pd  Pd179  1  0.931097  0.413907  0.680279  1
  Pd  Pd180  1  0.540848  0.753923  0.646355  1
  Pd  Pd181  1  0.453737  0.212555  0.687320  1
  Pd  Pd182  1  0.131271  0.525033  0.649006  1
  Pd  Pd183  1  0.791824  0.874744  0.671016  1
  Pd  Pd184  1  0.108993  0.977137  0.685159  1
  Pd  Pd185  1  0.684957  0.302219  0.656852  1
  Pd  Pd186  1  0.274414  0.646175  0.674178  1
  Pd  Pd187  1  0.746958  0.065245  0.670769  1
  Pd  Pd188  1  0.441889  0.396253  0.685715  1
  Pd  Pd189  1  0.766077  0.660837  0.679012  1
  Pd  Pd190  1  0.483589  0.964850  0.647475  1
  Pd  Pd191  1  0.175771  0.300193  0.661874  1
  Pd  Pd192  1  0.000693  0.545835  0.696112  1
