# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.42551198
_cell_length_b   16.96562723
_cell_length_c   46.20723505
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   97.51517673
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu
_chemical_formula_sum   Cu128
_cell_volume   3439.51200009
_cell_formula_units_Z   128
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
  Cu  Cu1  1  0.065848  0.191111  0.287011  1
  Cu  Cu2  1  0.315117  0.688800  0.300529  1
  Cu  Cu3  1  0.796721  0.315621  0.290395  1
  Cu  Cu4  1  0.042703  0.813156  0.303510  1
  Cu  Cu5  1  0.939578  0.943466  0.281161  1
  Cu  Cu6  1  0.191105  0.440005  0.293771  1
  Cu  Cu7  1  0.335576  0.066609  0.283773  1
  Cu  Cu8  1  0.585379  0.564355  0.297236  1
  Cu  Cu9  1  0.563166  0.185918  0.313315  1
  Cu  Cu10  1  0.812592  0.683204  0.326883  1
  Cu  Cu11  1  0.291840  0.310215  0.316668  1
  Cu  Cu12  1  0.540667  0.807998  0.329959  1
  Cu  Cu13  1  0.437761  0.937034  0.306761  1
  Cu  Cu14  1  0.688451  0.434544  0.320085  1
  Cu  Cu15  1  0.833899  0.061642  0.310099  1
  Cu  Cu16  1  0.084934  0.558913  0.323516  1
  Cu  Cu17  1  0.060659  0.180269  0.340927  1
  Cu  Cu18  1  0.310848  0.677413  0.354502  1
  Cu  Cu19  1  0.788896  0.304535  0.344301  1
  Cu  Cu20  1  0.037047  0.801164  0.357970  1
  Cu  Cu21  1  0.936974  0.931748  0.334362  1
  Cu  Cu22  1  0.185653  0.428821  0.347687  1
  Cu  Cu23  1  0.331375  0.055734  0.337535  1
  Cu  Cu24  1  0.582402  0.553074  0.351150  1
  Cu  Cu25  1  0.557914  0.174420  0.368711  1
  Cu  Cu26  1  0.807745  0.671442  0.382403  1
  Cu  Cu27  1  0.284993  0.298756  0.372141  1
  Cu  Cu28  1  0.533571  0.795686  0.385826  1
  Cu  Cu29  1  0.433405  0.925560  0.361767  1
  Cu  Cu30  1  0.682864  0.423038  0.375534  1
  Cu  Cu31  1  0.830170  0.050118  0.365429  1
  Cu  Cu32  1  0.080946  0.547279  0.378995  1
  Cu  Cu33  1  0.055390  0.168672  0.396582  1
  Cu  Cu34  1  0.304780  0.665770  0.410270  1
  Cu  Cu35  1  0.781398  0.292951  0.399997  1
  Cu  Cu36  1  0.030193  0.789949  0.413788  1
  Cu  Cu37  1  0.931096  0.919882  0.389631  1
  Cu  Cu38  1  0.180073  0.417239  0.403407  1
  Cu  Cu39  1  0.328737  0.044233  0.393184  1
  Cu  Cu40  1  0.578898  0.541491  0.406872  1
  Cu  Cu41  1  0.552703  0.162836  0.424439  1
  Cu  Cu42  1  0.801851  0.659967  0.438200  1
  Cu  Cu43  1  0.278341  0.287161  0.427884  1
  Cu  Cu44  1  0.527141  0.784214  0.441698  1
  Cu  Cu45  1  0.428723  0.914196  0.417447  1
  Cu  Cu46  1  0.677304  0.411442  0.431306  1
  Cu  Cu47  1  0.826871  0.038536  0.421070  1
  Cu  Cu48  1  0.076392  0.535721  0.434760  1
  Cu  Cu49  1  0.050068  0.157072  0.452331  1
  Cu  Cu50  1  0.298980  0.654200  0.466094  1
  Cu  Cu51  1  0.775437  0.281359  0.455758  1
  Cu  Cu52  1  0.024193  0.778451  0.469603  1
  Cu  Cu53  1  0.926023  0.908455  0.445322  1
  Cu  Cu54  1  0.174512  0.405651  0.459197  1
  Cu  Cu55  1  0.324543  0.032748  0.448909  1
  Cu  Cu56  1  0.573662  0.529922  0.462651  1
  Cu  Cu57  1  0.547365  0.151274  0.480210  1
  Cu  Cu58  1  0.796100  0.648418  0.493992  1
  Cu  Cu59  1  0.272630  0.275569  0.483643  1
  Cu  Cu60  1  0.521322  0.772691  0.497493  1
  Cu  Cu61  1  0.423217  0.902702  0.473200  1
  Cu  Cu62  1  0.671730  0.399852  0.487090  1
  Cu  Cu63  1  0.822040  0.026976  0.476782  1
  Cu  Cu64  1  0.070844  0.524137  0.490534  1
  Cu  Cu65  1  0.044640  0.145485  0.508103  1
  Cu  Cu66  1  0.293232  0.642641  0.521877  1
  Cu  Cu67  1  0.769867  0.269774  0.511526  1
  Cu  Cu68  1  0.018512  0.766932  0.525375  1
  Cu  Cu69  1  0.920380  0.896941  0.501091  1
  Cu  Cu70  1  0.168946  0.394056  0.514978  1
  Cu  Cu71  1  0.319425  0.021201  0.504657  1
  Cu  Cu72  1  0.567975  0.518350  0.518421  1
  Cu  Cu73  1  0.541909  0.139696  0.535994  1
  Cu  Cu74  1  0.790386  0.636872  0.549764  1
  Cu  Cu75  1  0.267156  0.263977  0.539411  1
  Cu  Cu76  1  0.515787  0.761181  0.553240  1
  Cu  Cu77  1  0.417540  0.891182  0.528988  1
  Cu  Cu78  1  0.666161  0.388266  0.542872  1
  Cu  Cu79  1  0.816744  0.015419  0.532549  1
  Cu  Cu80  1  0.065059  0.512552  0.546293  1
  Cu  Cu81  1  0.039176  0.133894  0.563895  1
  Cu  Cu82  1  0.287522  0.631088  0.577615  1
  Cu  Cu83  1  0.764535  0.258185  0.567294  1
  Cu  Cu84  1  0.013272  0.755444  0.581106  1
  Cu  Cu85  1  0.914725  0.885416  0.556898  1
  Cu  Cu86  1  0.163392  0.382461  0.570754  1
  Cu  Cu87  1  0.314009  0.009646  0.560439  1
  Cu  Cu88  1  0.562077  0.506788  0.574180  1
  Cu  Cu89  1  0.536480  0.128118  0.591796  1
  Cu  Cu90  1  0.784664  0.625392  0.605521  1
  Cu  Cu91  1  0.262115  0.252388  0.595183  1
  Cu  Cu92  1  0.511170  0.749757  0.608903  1
  Cu  Cu93  1  0.411999  0.879673  0.584815  1
  Cu  Cu94  1  0.660607  0.376674  0.598651  1
  Cu  Cu95  1  0.811116  0.003835  0.588361  1
  Cu  Cu96  1  0.058900  0.500959  0.602037  1
  Cu  Cu97  1  0.033708  0.122303  0.619683  1
  Cu  Cu98  1  0.281548  0.619437  0.633263  1
  Cu  Cu99  1  0.760207  0.246581  0.623049  1
  Cu  Cu100  1  0.009914  0.744228  0.636781  1
  Cu  Cu101  1  0.909569  0.873938  0.612776  1
  Cu  Cu102  1  0.157875  0.370874  0.626509  1
  Cu  Cu103  1  0.307961  0.998139  0.616236  1
  Cu  Cu104  1  0.555466  0.495235  0.629920  1
  Cu  Cu105  1  0.531011  0.116423  0.647542  1
  Cu  Cu106  1  0.779553  0.613970  0.661181  1
  Cu  Cu107  1  0.258739  0.240791  0.650894  1
  Cu  Cu108  1  0.507634  0.737795  0.664171  1
  Cu  Cu109  1  0.407076  0.868318  0.640632  1
  Cu  Cu110  1  0.655102  0.365102  0.654344  1
  Cu  Cu111  1  0.804318  0.992235  0.644130  1
  Cu  Cu112  1  0.051437  0.489395  0.657734  1
  Cu  Cu113  1  0.028456  0.110712  0.675144  1
  Cu  Cu114  1  0.277094  0.607761  0.688579  1
  Cu  Cu115  1  0.756142  0.235055  0.678514  1
  Cu  Cu116  1  0.007465  0.732730  0.691794  1
  Cu  Cu117  1  0.903185  0.861789  0.668627  1
  Cu  Cu118  1  0.152425  0.359406  0.681940  1
  Cu  Cu119  1  0.300786  0.986273  0.671800  1
  Cu  Cu120  1  0.549046  0.483722  0.685385  1
  Cu  Cu121  1  0.525736  0.105339  0.701471  1
  Cu  Cu122  1  0.777694  0.603092  0.714927  1
  Cu  Cu123  1  0.255430  0.229617  0.704810  1
  Cu  Cu124  1  0.507471  0.725489  0.717335  1
  Cu  Cu125  1  0.402973  0.856189  0.695067  1
  Cu  Cu126  1  0.649720  0.353909  0.708261  1
  Cu  Cu127  1  0.795546  0.981021  0.698107  1
  Cu  Cu128  1  0.043836  0.478235  0.711649  1
