# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.51365264
_cell_length_b   10.50170179
_cell_length_c   46.89916203
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   72.07978686
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu
_chemical_formula_sum   Cu180
_cell_volume   4926.97946529
_cell_formula_units_Z   180
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  0.634589  0.058478  0.292543  1
  Cu  Cu2  1  0.932507  0.694431  0.287282  1
  Cu  Cu3  1  0.923146  0.007699  0.323289  1
  Cu  Cu4  1  0.228751  1.000896  0.298934  1
  Cu  Cu5  1  0.619335  0.714264  0.308856  1
  Cu  Cu6  1  0.924531  0.364165  0.304280  1
  Cu  Cu7  1  0.313559  0.405705  0.296502  1
  Cu  Cu8  1  0.230513  0.649940  0.317493  1
  Cu  Cu9  1  0.544401  0.294826  0.312354  1
  Cu  Cu10  1  0.381814  0.802165  0.323423  1
  Cu  Cu11  1  0.690835  0.447004  0.319589  1
  Cu  Cu12  1  0.773538  0.859826  0.317461  1
  Cu  Cu13  1  0.080345  0.844293  0.292999  1
  Cu  Cu14  1  0.463760  0.560666  0.303055  1
  Cu  Cu15  1  0.785693  0.206943  0.298484  1
  Cu  Cu16  1  0.158237  0.260488  0.290641  1
  Cu  Cu17  1  0.081809  0.501492  0.311918  1
  Cu  Cu18  1  0.391469  0.143555  0.305014  1
  Cu  Cu19  1  0.535522  0.948651  0.331903  1
  Cu  Cu20  1  0.843028  0.593255  0.327715  1
  Cu  Cu21  1  0.838367  0.903413  0.367757  1
  Cu  Cu22  1  0.150478  0.891946  0.342126  1
  Cu  Cu23  1  0.532217  0.608276  0.352420  1
  Cu  Cu24  1  0.841066  0.252366  0.348244  1
  Cu  Cu25  1  0.228686  0.303615  0.339321  1
  Cu  Cu26  1  0.147864  0.545043  0.361888  1
  Cu  Cu27  1  0.456719  0.189348  0.355228  1
  Cu  Cu28  1  0.298795  0.695093  0.367929  1
  Cu  Cu29  1  0.607133  0.340247  0.362986  1
  Cu  Cu30  1  0.684651  0.755604  0.360024  1
  Cu  Cu31  1  0.999416  0.741354  0.336030  1
  Cu  Cu32  1  0.380579  0.454835  0.345800  1
  Cu  Cu33  1  0.692060  0.101420  0.341552  1
  Cu  Cu34  1  0.069575  0.158612  0.330848  1
  Cu  Cu35  1  0.994532  0.398031  0.354730  1
  Cu  Cu36  1  0.301258  0.042610  0.348282  1
  Cu  Cu37  1  0.449031  0.844770  0.374960  1
  Cu  Cu38  1  0.758695  0.488287  0.370449  1
  Cu  Cu39  1  0.752461  0.798198  0.410683  1
  Cu  Cu40  1  0.066262  0.785931  0.385522  1
  Cu  Cu41  1  0.447711  0.500694  0.395981  1
  Cu  Cu42  1  0.756660  0.144004  0.391297  1
  Cu  Cu43  1  0.141084  0.200214  0.381625  1
  Cu  Cu44  1  0.061789  0.440934  0.405213  1
  Cu  Cu45  1  0.369710  0.084730  0.398946  1
  Cu  Cu46  1  0.214515  0.589815  0.412298  1
  Cu  Cu47  1  0.522547  0.232910  0.406321  1
  Cu  Cu48  1  0.599443  0.650257  0.403186  1
  Cu  Cu49  1  0.912222  0.635981  0.377826  1
  Cu  Cu50  1  0.295858  0.349146  0.389144  1
  Cu  Cu51  1  0.602816  0.992881  0.382795  1
  Cu  Cu52  1  0.988834  0.052031  0.374485  1
  Cu  Cu53  1  0.908860  0.293219  0.398327  1
  Cu  Cu54  1  0.217375  0.936143  0.392183  1
  Cu  Cu55  1  0.365584  0.739422  0.419083  1
  Cu  Cu56  1  0.674239  0.382713  0.413888  1
  Cu  Cu57  1  0.666970  0.692850  0.453991  1
  Cu  Cu58  1  0.979935  0.680165  0.428372  1
  Cu  Cu59  1  0.362775  0.393925  0.439585  1
  Cu  Cu60  1  0.670383  0.036687  0.433783  1
  Cu  Cu61  1  0.056886  0.095822  0.425284  1
  Cu  Cu62  1  0.976056  0.335850  0.448696  1
  Cu  Cu63  1  0.284788  0.979142  0.442807  1
  Cu  Cu64  1  0.128792  0.484439  0.455718  1
  Cu  Cu65  1  0.437016  0.127599  0.449899  1
  Cu  Cu66  1  0.514686  0.543937  0.446773  1
  Cu  Cu67  1  0.826789  0.531555  0.421106  1
  Cu  Cu68  1  0.209636  0.244436  0.432336  1
  Cu  Cu69  1  0.517594  0.888124  0.426182  1
  Cu  Cu70  1  0.905109  0.946917  0.418304  1
  Cu  Cu71  1  0.823432  0.186740  0.441584  1
  Cu  Cu72  1  0.132703  0.829908  0.435824  1
  Cu  Cu73  1  0.281133  0.633616  0.462907  1
  Cu  Cu74  1  0.589409  0.276384  0.457216  1
  Cu  Cu75  1  0.582130  0.587128  0.497582  1
  Cu  Cu76  1  0.894393  0.574954  0.471767  1
  Cu  Cu77  1  0.277231  0.288364  0.483019  1
  Cu  Cu78  1  0.585405  0.931409  0.477222  1
  Cu  Cu79  1  0.972140  0.990443  0.468840  1
  Cu  Cu80  1  0.890569  0.229947  0.492028  1
  Cu  Cu81  1  0.199674  0.873311  0.486310  1
  Cu  Cu82  1  0.043162  0.378930  0.499147  1
  Cu  Cu83  1  0.352089  0.022114  0.493541  1
  Cu  Cu84  1  0.429786  0.437644  0.490262  1
  Cu  Cu85  1  0.741731  0.426036  0.464585  1
  Cu  Cu86  1  0.124586  0.139449  0.475931  1
  Cu  Cu87  1  0.433203  0.782832  0.470017  1
  Cu  Cu88  1  0.819624  0.841268  0.461383  1
  Cu  Cu89  1  0.737830  0.080263  0.484577  1
  Cu  Cu90  1  0.047079  0.723872  0.478979  1
  Cu  Cu91  1  0.195729  0.527725  0.506255  1
  Cu  Cu92  1  0.504371  0.170740  0.500739  1
  Cu  Cu93  1  0.497027  0.481125  0.540952  1
  Cu  Cu94  1  0.809208  0.469590  0.515310  1
  Cu  Cu95  1  0.192082  0.183018  0.526561  1
  Cu  Cu96  1  0.500817  0.826108  0.520913  1
  Cu  Cu97  1  0.886827  0.884532  0.512037  1
  Cu  Cu98  1  0.805191  0.123802  0.535263  1
  Cu  Cu99  1  0.114398  0.767371  0.529579  1
  Cu  Cu100  1  0.957654  0.273378  0.542550  1
  Cu  Cu101  1  0.266750  0.916654  0.536896  1
  Cu  Cu102  1  0.344648  0.331842  0.533719  1
  Cu  Cu103  1  0.656688  0.319940  0.507934  1
  Cu  Cu104  1  0.039357  0.033973  0.519376  1
  Cu  Cu105  1  0.348219  0.677020  0.513474  1
  Cu  Cu106  1  0.734434  0.735803  0.504788  1
  Cu  Cu107  1  0.653064  0.974708  0.528141  1
  Cu  Cu108  1  0.961852  0.618476  0.522470  1
  Cu  Cu109  1  0.110179  0.421995  0.549633  1
  Cu  Cu110  1  0.419475  0.065084  0.544298  1
  Cu  Cu111  1  0.412096  0.375175  0.584415  1
  Cu  Cu112  1  0.723843  0.363562  0.558595  1
  Cu  Cu113  1  0.106585  0.077786  0.569914  1
  Cu  Cu114  1  0.415292  0.720151  0.563991  1
  Cu  Cu115  1  0.801833  0.778822  0.555598  1
  Cu  Cu116  1  0.720767  0.018093  0.579015  1
  Cu  Cu117  1  0.029625  0.662162  0.573199  1
  Cu  Cu118  1  0.872153  0.167651  0.585887  1
  Cu  Cu119  1  0.181833  0.810768  0.580217  1
  Cu  Cu120  1  0.259629  0.226506  0.577215  1
  Cu  Cu121  1  0.571785  0.213939  0.551502  1
  Cu  Cu122  1  0.954102  0.927864  0.562601  1
  Cu  Cu123  1  0.262808  0.570753  0.556728  1
  Cu  Cu124  1  0.649611  0.630373  0.548486  1
  Cu  Cu125  1  0.568513  0.869306  0.571862  1
  Cu  Cu126  1  0.876716  0.513560  0.566094  1
  Cu  Cu127  1  0.024579  0.316946  0.593117  1
  Cu  Cu128  1  0.333789  0.959911  0.587561  1
  Cu  Cu129  1  0.327953  0.269956  0.627866  1
  Cu  Cu130  1  0.638735  0.257257  0.602268  1
  Cu  Cu131  1  0.021305  0.971814  0.612928  1
  Cu  Cu132  1  0.329756  0.613185  0.607117  1
  Cu  Cu133  1  0.716989  0.673437  0.599610  1
  Cu  Cu134  1  0.637060  0.912538  0.622911  1
  Cu  Cu135  1  0.944968  0.558241  0.616903  1
  Cu  Cu136  1  0.788089  0.062722  0.629901  1
  Cu  Cu137  1  0.098070  0.706023  0.624098  1
  Cu  Cu138  1  0.174280  0.121956  0.620440  1
  Cu  Cu139  1  0.487043  0.107768  0.595067  1
  Cu  Cu140  1  0.869470  0.821841  0.606320  1
  Cu  Cu141  1  0.177246  0.464721  0.600057  1
  Cu  Cu142  1  0.564018  0.524317  0.591737  1
  Cu  Cu143  1  0.481887  0.762828  0.614379  1
  Cu  Cu144  1  0.790728  0.407792  0.609092  1
  Cu  Cu145  1  0.938832  0.212018  0.636431  1
  Cu  Cu146  1  0.249076  0.854153  0.631016  1
  Cu  Cu147  1  0.242699  0.165399  0.670482  1
  Cu  Cu148  1  0.554475  0.149914  0.645871  1
  Cu  Cu149  1  0.936794  0.866285  0.656350  1
  Cu  Cu150  1  0.245475  0.505697  0.650211  1
  Cu  Cu151  1  0.629897  0.567207  0.642729  1
  Cu  Cu152  1  0.547900  0.805345  0.664096  1
  Cu  Cu153  1  0.858423  0.452339  0.658881  1
  Cu  Cu154  1  0.704967  0.956050  0.673889  1
  Cu  Cu155  1  0.017295  0.598947  0.667608  1
  Cu  Cu156  1  0.088451  0.016240  0.662558  1
  Cu  Cu157  1  0.401626  1.002856  0.638257  1
  Cu  Cu158  1  0.785284  0.715925  0.650775  1
  Cu  Cu159  1  0.092078  0.359937  0.643563  1
  Cu  Cu160  1  0.479462  0.417850  0.635342  1
  Cu  Cu161  1  0.394570  0.655845  0.657227  1
  Cu  Cu162  1  0.705480  0.302192  0.652662  1
  Cu  Cu163  1  0.855458  0.107264  0.680512  1
  Cu  Cu164  1  0.163151  0.751585  0.675555  1
  Cu  Cu165  1  0.155036  0.064169  0.711283  1
  Cu  Cu166  1  0.465419  0.046639  0.689536  1
  Cu  Cu167  1  0.861714  0.757549  0.700194  1
  Cu  Cu168  1  0.162146  0.393761  0.694109  1
  Cu  Cu169  1  0.542625  0.462359  0.686214  1
  Cu  Cu170  1  0.455957  0.700205  0.706614  1
  Cu  Cu171  1  0.773719  0.348218  0.702004  1
  Cu  Cu172  1  0.617283  0.842010  0.712448  1
  Cu  Cu173  1  0.927937  0.496891  0.707804  1
  Cu  Cu174  1  0.004168  0.916646  0.705726  1
  Cu  Cu175  1  0.315689  0.897836  0.681709  1
  Cu  Cu176  1  0.696468  0.609434  0.692898  1
  Cu  Cu177  1  0.004947  0.255701  0.686455  1
  Cu  Cu178  1  0.396190  0.311609  0.678756  1
  Cu  Cu179  1  0.301153  0.551543  0.699983  1
  Cu  Cu180  1  0.622964  0.193489  0.695840  1
