# generated using pymatgen
data_HPd3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.04376143
_cell_length_b   19.46553669
_cell_length_c   50.88412124
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   91.21452813
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HPd3
_chemical_formula_sum   'H54 Pd162'
_cell_volume   5984.92061929
_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  1.002770  0.206715  0.294357  1
  H  H2  1  0.631943  0.926725  0.291015  1
  H  H3  1  0.372746  0.601650  0.294296  1
  H  H4  1  0.566534  0.480137  0.287629  1
  H  H5  1  0.112553  0.075361  0.279261  1
  H  H6  1  0.883426  0.744399  0.290055  1
  H  H7  1  0.338412  0.315184  0.300260  1
  H  H8  1  0.897648  0.958990  0.331002  1
  H  H9  1  0.580778  0.621355  0.350961  1
  H  H10  1  0.784210  0.370376  0.299927  1
  H  H11  1  0.427656  0.175221  0.286098  1
  H  H12  1  0.342631  0.813337  0.289871  1
  H  H13  1  0.297888  0.295321  0.366609  1
  H  H14  1  0.036455  0.978204  0.387469  1
  H  H15  1  0.766386  0.652330  0.402105  1
  H  H16  1  0.886957  0.515478  0.374176  1
  H  H17  1  0.605430  0.193317  0.392316  1
  H  H18  1  0.151381  0.840242  0.360090  1
  H  H19  1  0.492380  0.327499  0.417535  1
  H  H20  1  0.221542  1.008260  0.437355  1
  H  H21  1  0.951594  0.683796  0.451262  1
  H  H22  1  0.071895  0.546697  0.424533  1
  H  H23  1  0.798353  0.225614  0.442417  1
  H  H24  1  0.340817  0.871254  0.410388  1
  H  H25  1  0.677121  0.359749  0.467858  1
  H  H26  1  0.403031  0.039612  0.487140  1
  H  H27  1  0.134677  0.715691  0.500423  1
  H  H28  1  0.256310  0.578384  0.473822  1
  H  H29  1  0.982635  0.257493  0.492639  1
  H  H30  1  0.526280  0.903046  0.460226  1
  H  H31  1  0.860839  0.391610  0.518008  1
  H  H32  1  0.584465  0.071581  0.537074  1
  H  H33  1  0.318749  0.748230  0.549586  1
  H  H34  1  0.438914  0.610203  0.523006  1
  H  H35  1  0.166904  0.290030  0.542966  1
  H  H36  1  0.709657  0.935257  0.509965  1
  H  H37  1  0.047092  0.423845  0.568176  1
  H  H38  1  0.764760  0.103477  0.588041  1
  H  H39  1  0.505530  0.781406  0.599442  1
  H  H40  1  0.624952  0.642806  0.571852  1
  H  H41  1  0.356875  0.322201  0.593960  1
  H  H42  1  0.894858  0.968298  0.559719  1
  H  H43  1  0.237780  0.448231  0.621570  1
  H  H44  1  0.876144  0.234695  0.662089  1
  H  H45  1  0.623701  0.925706  0.675360  1
  H  H46  1  0.808973  0.674431  0.622947  1
  H  H47  1  0.134699  0.349798  0.665156  1
  H  H48  1  0.090495  1.000251  0.610522  1
  H  H49  1  0.447930  0.478498  0.674020  1
  H  H50  1  0.188494  0.141293  0.678226  1
  H  H51  1  0.832197  0.819612  0.688114  1
  H  H52  1  0.010828  0.696021  0.679588  1
  H  H53  1  0.566271  0.349028  0.654444  1
  H  H54  1  0.327630  0.018488  0.666004  1
  Pd  Pd55  1  0.799043  0.263897  0.301316  1
  Pd  Pd56  1  0.389458  0.897494  0.280574  1
  Pd  Pd57  1  0.102187  0.577894  0.293108  1
  Pd  Pd58  1  0.110539  0.366336  0.308695  1
  Pd  Pd59  1  0.643606  0.011055  0.284869  1
  Pd  Pd60  1  0.375893  0.688898  0.294360  1
  Pd  Pd61  1  0.254007  0.241006  0.285108  1
  Pd  Pd62  1  0.954875  0.911751  0.303162  1
  Pd  Pd63  1  0.509995  0.554496  0.274865  1
  Pd  Pd64  1  0.831343  0.463771  0.291259  1
  Pd  Pd65  1  0.346973  0.110460  0.269118  1
  Pd  Pd66  1  0.095264  0.787851  0.279019  1
  Pd  Pd67  1  0.519836  0.367687  0.286534  1
  Pd  Pd68  1  0.056633  1.003232  0.267648  1
  Pd  Pd69  1  0.795936  0.673801  0.278361  1
  Pd  Pd70  1  0.397074  0.479770  0.315114  1
  Pd  Pd71  1  0.903851  0.133351  0.281338  1
  Pd  Pd72  1  0.665485  0.800818  0.296398  1
  Pd  Pd73  1  1.004875  0.287800  0.353285  1
  Pd  Pd74  1  0.566379  0.932871  0.328346  1
  Pd  Pd75  1  0.288062  0.608531  0.340128  1
  Pd  Pd76  1  0.302303  0.395529  0.359180  1
  Pd  Pd77  1  0.843521  0.047434  0.331075  1
  Pd  Pd78  1  0.574236  0.718383  0.342877  1
  Pd  Pd79  1  0.429084  0.273468  0.333787  1
  Pd  Pd80  1  0.146483  0.945943  0.352415  1
  Pd  Pd81  1  0.700219  0.591630  0.319994  1
  Pd  Pd82  1  0.999919  0.496451  0.339925  1
  Pd  Pd83  1  0.544670  0.145947  0.313713  1
  Pd  Pd84  1  0.282371  0.819990  0.325952  1
  Pd  Pd85  1  0.711125  0.385296  0.334814  1
  Pd  Pd86  1  0.250082  0.031395  0.311504  1
  Pd  Pd87  1  0.990759  0.707802  0.322849  1
  Pd  Pd88  1  0.588643  0.510930  0.363003  1
  Pd  Pd89  1  0.104296  0.164329  0.327762  1
  Pd  Pd90  1  0.859507  0.831959  0.347411  1
  Pd  Pd91  1  0.194037  0.318072  0.403062  1
  Pd  Pd92  1  0.746428  0.967216  0.376435  1
  Pd  Pd93  1  0.473535  0.639900  0.388859  1
  Pd  Pd94  1  0.491651  0.426350  0.408714  1
  Pd  Pd95  1  0.035859  0.076659  0.379996  1
  Pd  Pd96  1  0.758144  0.750433  0.393036  1
  Pd  Pd97  1  0.616675  0.300788  0.382898  1
  Pd  Pd98  1  0.334601  0.979811  0.401664  1
  Pd  Pd99  1  0.888321  0.624328  0.367257  1
  Pd  Pd100  1  0.185701  0.526296  0.388178  1
  Pd  Pd101  1  0.738163  0.174422  0.360528  1
  Pd  Pd102  1  0.460506  0.852427  0.374738  1
  Pd  Pd103  1  0.893841  0.416753  0.383434  1
  Pd  Pd104  1  0.438373  0.063892  0.356887  1
  Pd  Pd105  1  0.176686  0.741144  0.370524  1
  Pd  Pd106  1  0.774737  0.542590  0.411449  1
  Pd  Pd107  1  0.306084  0.192827  0.377338  1
  Pd  Pd108  1  0.041854  0.866048  0.396745  1
  Pd  Pd109  1  0.378113  0.349665  0.453087  1
  Pd  Pd110  1  0.927118  0.998321  0.425097  1
  Pd  Pd111  1  0.655586  0.671628  0.438188  1
  Pd  Pd112  1  0.675964  0.457911  0.458304  1
  Pd  Pd113  1  0.219068  0.106795  0.429858  1
  Pd  Pd114  1  0.941085  0.782398  0.442593  1
  Pd  Pd115  1  0.801046  0.331702  0.432510  1
  Pd  Pd116  1  0.519146  0.011175  0.451037  1
  Pd  Pd117  1  0.070433  0.656447  0.415980  1
  Pd  Pd118  1  0.369154  0.557645  0.437348  1
  Pd  Pd119  1  0.921211  0.204235  0.408473  1
  Pd  Pd120  1  0.641273  0.884165  0.423805  1
  Pd  Pd121  1  0.077767  0.447946  0.432584  1
  Pd  Pd122  1  0.617481  0.097186  0.404123  1
  Pd  Pd123  1  0.356060  0.773065  0.419293  1
  Pd  Pd124  1  0.957496  0.574287  0.460480  1
  Pd  Pd125  1  0.492489  0.222568  0.427511  1
  Pd  Pd126  1  0.224673  0.898461  0.446147  1
  Pd  Pd127  1  0.560554  0.381567  0.502898  1
  Pd  Pd128  1  0.109353  0.029338  0.474612  1
  Pd  Pd129  1  0.838450  0.703181  0.487446  1
  Pd  Pd130  1  0.858349  0.489487  0.507716  1
  Pd  Pd131  1  0.400787  0.138156  0.479706  1
  Pd  Pd132  1  0.124082  0.813885  0.491908  1
  Pd  Pd133  1  0.983246  0.363313  0.482288  1
  Pd  Pd134  1  0.700334  0.043044  0.500189  1
  Pd  Pd135  1  0.252577  0.687974  0.464958  1
  Pd  Pd136  1  0.551981  0.589058  0.486651  1
  Pd  Pd137  1  0.101665  0.235213  0.457933  1
  Pd  Pd138  1  0.823806  0.915560  0.473281  1
  Pd  Pd139  1  0.260295  0.479563  0.482006  1
  Pd  Pd140  1  0.798541  0.128147  0.452985  1
  Pd  Pd141  1  0.537648  0.804734  0.468382  1
  Pd  Pd142  1  0.140224  0.605844  0.509521  1
  Pd  Pd143  1  0.676267  0.254003  0.477877  1
  Pd  Pd144  1  0.406770  0.930179  0.495584  1
  Pd  Pd145  1  0.742877  0.413120  0.552659  1
  Pd  Pd146  1  0.291935  0.061232  0.524387  1
  Pd  Pd147  1  0.021409  0.734945  0.536690  1
  Pd  Pd148  1  0.039091  0.521465  0.556672  1
  Pd  Pd149  1  0.581992  0.170428  0.529028  1
  Pd  Pd150  1  0.306193  0.845780  0.541104  1
  Pd  Pd151  1  0.165467  0.395225  0.532020  1
  Pd  Pd152  1  0.880184  0.074864  0.549064  1
  Pd  Pd153  1  0.435293  0.719759  0.513941  1
  Pd  Pd154  1  0.734805  0.620988  0.535837  1
  Pd  Pd155  1  0.282238  0.267314  0.507549  1
  Pd  Pd156  1  1.006570  0.947988  0.523040  1
  Pd  Pd157  1  0.443558  0.511259  0.531561  1
  Pd  Pd158  1  0.980460  0.159621  0.502449  1
  Pd  Pd159  1  0.721169  0.836861  0.517697  1
  Pd  Pd160  1  0.323025  0.637904  0.558414  1
  Pd  Pd161  1  0.859076  0.285793  0.527973  1
  Pd  Pd162  1  0.587408  0.962106  0.544901  1
  Pd  Pd163  1  0.923038  0.445239  0.601841  1
  Pd  Pd164  1  0.475854  0.093759  0.574152  1
  Pd  Pd165  1  0.204907  0.767848  0.585809  1
  Pd  Pd166  1  0.217357  0.554586  0.604922  1
  Pd  Pd167  1  0.764263  0.201856  0.578274  1
  Pd  Pd168  1  0.490138  0.878438  0.590682  1
  Pd  Pd169  1  0.347173  0.427465  0.581552  1
  Pd  Pd170  1  0.060973  0.105801  0.596977  1
  Pd  Pd171  1  0.617953  0.752967  0.562779  1
  Pd  Pd172  1  0.917531  0.653989  0.584810  1
  Pd  Pd173  1  0.464580  0.299778  0.557328  1
  Pd  Pd174  1  0.191969  0.980887  0.573342  1
  Pd  Pd175  1  0.626826  0.543825  0.581122  1
  Pd  Pd176  1  0.163728  0.191745  0.552012  1
  Pd  Pd177  1  0.905269  0.869986  0.567245  1
  Pd  Pd178  1  0.505897  0.671844  0.606720  1
  Pd  Pd179  1  0.040713  0.317582  0.577861  1
  Pd  Pd180  1  0.768265  0.994165  0.593897  1
  Pd  Pd181  1  0.102265  0.479101  0.649640  1
  Pd  Pd182  1  0.664732  0.124191  0.623900  1
  Pd  Pd183  1  0.391440  0.798251  0.634260  1
  Pd  Pd184  1  0.399923  0.591036  0.650514  1
  Pd  Pd185  1  0.945249  0.235353  0.626804  1
  Pd  Pd186  1  0.678662  0.908803  0.639875  1
  Pd  Pd187  1  0.530474  0.462045  0.630639  1
  Pd  Pd188  1  0.249608  0.138089  0.642709  1
  Pd  Pd189  1  0.803670  0.785588  0.611126  1
  Pd  Pd190  1  0.101960  0.686630  0.633290  1
  Pd  Pd191  1  0.645906  0.333616  0.607745  1
  Pd  Pd192  1  0.385644  0.011695  0.624597  1
  Pd  Pd193  1  0.810893  0.577476  0.630565  1
  Pd  Pd194  1  0.352749  0.224557  0.601538  1
  Pd  Pd195  1  0.093924  0.901664  0.616861  1
  Pd  Pd196  1  0.691300  0.704777  0.653999  1
  Pd  Pd197  1  0.221061  0.349910  0.627742  1
  Pd  Pd198  1  0.958690  0.022583  0.641476  1
  Pd  Pd199  1  0.297291  0.518982  0.693073  1
  Pd  Pd200  1  0.873047  0.151120  0.671723  1
  Pd  Pd201  1  0.557455  0.828312  0.683334  1
  Pd  Pd202  1  0.596454  0.624548  0.694008  1
  Pd  Pd203  1  0.126510  0.264666  0.674220  1
  Pd  Pd204  1  0.874430  0.917077  0.688160  1
  Pd  Pd205  1  0.715110  0.497745  0.676990  1
  Pd  Pd206  1  0.441656  0.159161  0.686077  1
  Pd  Pd207  1  0.996993  0.812819  0.658901  1
  Pd  Pd208  1  0.287304  0.716098  0.681136  1
  Pd  Pd209  1  0.839822  0.364309  0.660463  1
  Pd  Pd210  1  0.601445  0.023665  0.674605  1
  Pd  Pd211  1  1.003486  0.610505  0.678126  1
  Pd  Pd212  1  0.554621  0.256490  0.652170  1
  Pd  Pd213  1  0.284874  0.927432  0.666862  1
  Pd  Pd214  1  0.880664  0.741766  0.699880  1
  Pd  Pd215  1  0.388889  0.388214  0.675534  1
  Pd  Pd216  1  0.161476  0.054310  0.686183  1
