# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.38733056
_cell_length_b   11.37992472
_cell_length_c   49.16721979
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   84.26082952
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu
_chemical_formula_sum   Cu252
_cell_volume   6339.49356918
_cell_formula_units_Z   252
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  0.064627  0.398767  0.320842  1
  Cu  Cu2  1  0.397960  0.065434  0.320842  1
  Cu  Cu3  1  0.461350  0.462220  0.277396  1
  Cu  Cu4  1  0.731294  0.732100  0.320842  1
  Cu  Cu5  1  0.794684  0.128887  0.277396  1
  Cu  Cu6  1  0.762366  0.429807  0.297867  1
  Cu  Cu7  1  0.128017  0.795554  0.277396  1
  Cu  Cu8  1  0.095699  0.096474  0.297867  1
  Cu  Cu9  1  0.429033  0.763140  0.297867  1
  Cu  Cu10  1  0.929033  0.263140  0.297867  1
  Cu  Cu11  1  0.262366  0.929807  0.297867  1
  Cu  Cu12  1  0.231294  0.232100  0.320842  1
  Cu  Cu13  1  0.595699  0.596474  0.297867  1
  Cu  Cu14  1  0.564627  0.898767  0.320842  1
  Cu  Cu15  1  0.628017  0.295554  0.277396  1
  Cu  Cu16  1  0.897960  0.565434  0.320842  1
  Cu  Cu17  1  0.961350  0.962220  0.277396  1
  Cu  Cu18  1  0.294684  0.628887  0.277396  1
  Cu  Cu19  1  0.128017  0.295554  0.277396  1
  Cu  Cu20  1  0.461350  0.962220  0.277396  1
  Cu  Cu21  1  0.429033  0.263140  0.297867  1
  Cu  Cu22  1  0.794684  0.628887  0.277396  1
  Cu  Cu23  1  0.762366  0.929807  0.297867  1
  Cu  Cu24  1  0.731294  0.232100  0.320842  1
  Cu  Cu25  1  0.095699  0.596474  0.297867  1
  Cu  Cu26  1  0.064627  0.898767  0.320842  1
  Cu  Cu27  1  0.397960  0.565434  0.320842  1
  Cu  Cu28  1  0.961350  0.462220  0.277396  1
  Cu  Cu29  1  0.294684  0.128887  0.277396  1
  Cu  Cu30  1  0.262366  0.429807  0.297867  1
  Cu  Cu31  1  0.628017  0.795554  0.277396  1
  Cu  Cu32  1  0.595699  0.096474  0.297867  1
  Cu  Cu33  1  0.564627  0.398767  0.320842  1
  Cu  Cu34  1  0.929033  0.763140  0.297867  1
  Cu  Cu35  1  0.897960  0.065434  0.320842  1
  Cu  Cu36  1  0.231294  0.732100  0.320842  1
  Cu  Cu37  1  0.972997  0.307029  0.387283  1
  Cu  Cu38  1  0.306330  0.973695  0.387283  1
  Cu  Cu39  1  0.367461  0.368211  0.342561  1
  Cu  Cu40  1  0.639664  0.640362  0.387283  1
  Cu  Cu41  1  0.700794  0.034878  0.342561  1
  Cu  Cu42  1  0.670366  0.337770  0.365202  1
  Cu  Cu43  1  0.034127  0.701545  0.342561  1
  Cu  Cu44  1  0.003699  0.004436  0.365202  1
  Cu  Cu45  1  0.337033  0.671103  0.365202  1
  Cu  Cu46  1  0.837033  0.171103  0.365202  1
  Cu  Cu47  1  0.170366  0.837770  0.365202  1
  Cu  Cu48  1  0.139664  0.140362  0.387283  1
  Cu  Cu49  1  0.503699  0.504436  0.365202  1
  Cu  Cu50  1  0.472997  0.807029  0.387283  1
  Cu  Cu51  1  0.534127  0.201545  0.342561  1
  Cu  Cu52  1  0.806330  0.473695  0.387283  1
  Cu  Cu53  1  0.867461  0.868211  0.342561  1
  Cu  Cu54  1  0.200794  0.534878  0.342561  1
  Cu  Cu55  1  0.034127  0.201545  0.342561  1
  Cu  Cu56  1  0.367461  0.868211  0.342561  1
  Cu  Cu57  1  0.337033  0.171103  0.365202  1
  Cu  Cu58  1  0.700794  0.534878  0.342561  1
  Cu  Cu59  1  0.670366  0.837770  0.365202  1
  Cu  Cu60  1  0.639664  0.140362  0.387283  1
  Cu  Cu61  1  0.003699  0.504436  0.365202  1
  Cu  Cu62  1  0.972997  0.807029  0.387283  1
  Cu  Cu63  1  0.306330  0.473695  0.387283  1
  Cu  Cu64  1  0.867461  0.368211  0.342561  1
  Cu  Cu65  1  0.200794  0.034878  0.342561  1
  Cu  Cu66  1  0.170366  0.337770  0.365202  1
  Cu  Cu67  1  0.534127  0.701545  0.342561  1
  Cu  Cu68  1  0.503699  0.004436  0.365202  1
  Cu  Cu69  1  0.472997  0.307029  0.387283  1
  Cu  Cu70  1  0.837033  0.671103  0.365202  1
  Cu  Cu71  1  0.806330  0.973695  0.387283  1
  Cu  Cu72  1  0.139664  0.640362  0.387283  1
  Cu  Cu73  1  0.881157  0.215104  0.454234  1
  Cu  Cu74  1  0.214490  0.881771  0.454234  1
  Cu  Cu75  1  0.275752  0.276426  0.409693  1
  Cu  Cu76  1  0.547824  0.548437  0.454234  1
  Cu  Cu77  1  0.609085  0.943093  0.409693  1
  Cu  Cu78  1  0.578434  0.245742  0.431907  1
  Cu  Cu79  1  0.942419  0.609760  0.409693  1
  Cu  Cu80  1  0.911767  0.912409  0.431907  1
  Cu  Cu81  1  0.245100  0.579075  0.431907  1
  Cu  Cu82  1  0.745100  0.079075  0.431907  1
  Cu  Cu83  1  0.078434  0.745742  0.431907  1
  Cu  Cu84  1  0.047824  0.048437  0.454234  1
  Cu  Cu85  1  0.411767  0.412409  0.431907  1
  Cu  Cu86  1  0.381157  0.715104  0.454234  1
  Cu  Cu87  1  0.442419  0.109760  0.409693  1
  Cu  Cu88  1  0.714490  0.381771  0.454234  1
  Cu  Cu89  1  0.775752  0.776426  0.409693  1
  Cu  Cu90  1  0.109085  0.443093  0.409693  1
  Cu  Cu91  1  0.942419  0.109760  0.409693  1
  Cu  Cu92  1  0.275752  0.776426  0.409693  1
  Cu  Cu93  1  0.245100  0.079075  0.431907  1
  Cu  Cu94  1  0.609085  0.443093  0.409693  1
  Cu  Cu95  1  0.578434  0.745742  0.431907  1
  Cu  Cu96  1  0.547824  0.048437  0.454234  1
  Cu  Cu97  1  0.911767  0.412409  0.431907  1
  Cu  Cu98  1  0.881157  0.715104  0.454234  1
  Cu  Cu99  1  0.214490  0.381771  0.454234  1
  Cu  Cu100  1  0.775752  0.276426  0.409693  1
  Cu  Cu101  1  0.109085  0.943093  0.409693  1
  Cu  Cu102  1  0.078434  0.245742  0.431907  1
  Cu  Cu103  1  0.442419  0.609760  0.409693  1
  Cu  Cu104  1  0.411767  0.912409  0.431907  1
  Cu  Cu105  1  0.381157  0.215104  0.454234  1
  Cu  Cu106  1  0.745100  0.579075  0.431907  1
  Cu  Cu107  1  0.714490  0.881771  0.454234  1
  Cu  Cu108  1  0.047824  0.548437  0.454234  1
  Cu  Cu109  1  0.789277  0.123134  0.521084  1
  Cu  Cu110  1  0.122610  0.789801  0.521084  1
  Cu  Cu111  1  0.183857  0.184440  0.476499  1
  Cu  Cu112  1  0.455943  0.456467  0.521084  1
  Cu  Cu113  1  0.517190  0.851107  0.476499  1
  Cu  Cu114  1  0.486567  0.153787  0.498791  1
  Cu  Cu115  1  0.850523  0.517773  0.476499  1
  Cu  Cu116  1  0.819900  0.820454  0.498791  1
  Cu  Cu117  1  0.153233  0.487120  0.498791  1
  Cu  Cu118  1  0.653233  0.987120  0.498791  1
  Cu  Cu119  1  0.986567  0.653787  0.498791  1
  Cu  Cu120  1  0.955943  0.956467  0.521084  1
  Cu  Cu121  1  0.319900  0.320454  0.498791  1
  Cu  Cu122  1  0.289277  0.623134  0.521084  1
  Cu  Cu123  1  0.350523  0.017773  0.476499  1
  Cu  Cu124  1  0.622610  0.289801  0.521084  1
  Cu  Cu125  1  0.683857  0.684440  0.476499  1
  Cu  Cu126  1  0.017190  0.351107  0.476499  1
  Cu  Cu127  1  0.850523  0.017773  0.476499  1
  Cu  Cu128  1  0.183857  0.684440  0.476499  1
  Cu  Cu129  1  0.153233  0.987120  0.498791  1
  Cu  Cu130  1  0.517190  0.351107  0.476499  1
  Cu  Cu131  1  0.486567  0.653787  0.498791  1
  Cu  Cu132  1  0.455943  0.956467  0.521084  1
  Cu  Cu133  1  0.819900  0.320454  0.498791  1
  Cu  Cu134  1  0.789277  0.623134  0.521084  1
  Cu  Cu135  1  0.122610  0.289801  0.521084  1
  Cu  Cu136  1  0.683857  0.184440  0.476499  1
  Cu  Cu137  1  0.017190  0.851107  0.476499  1
  Cu  Cu138  1  0.986567  0.153787  0.498791  1
  Cu  Cu139  1  0.350523  0.517773  0.476499  1
  Cu  Cu140  1  0.319900  0.820454  0.498791  1
  Cu  Cu141  1  0.289277  0.123134  0.521084  1
  Cu  Cu142  1  0.653233  0.487120  0.498791  1
  Cu  Cu143  1  0.622610  0.789801  0.521084  1
  Cu  Cu144  1  0.955943  0.456467  0.521084  1
  Cu  Cu145  1  0.697381  0.031148  0.587890  1
  Cu  Cu146  1  0.030715  0.697814  0.587890  1
  Cu  Cu147  1  0.091976  0.092470  0.543349  1
  Cu  Cu148  1  0.364048  0.364481  0.587890  1
  Cu  Cu149  1  0.425310  0.759137  0.543349  1
  Cu  Cu150  1  0.394700  0.061832  0.565676  1
  Cu  Cu151  1  0.758643  0.425803  0.543349  1
  Cu  Cu152  1  0.728033  0.728499  0.565676  1
  Cu  Cu153  1  0.061366  0.395165  0.565676  1
  Cu  Cu154  1  0.561366  0.895165  0.565676  1
  Cu  Cu155  1  0.894700  0.561832  0.565676  1
  Cu  Cu156  1  0.864048  0.864481  0.587890  1
  Cu  Cu157  1  0.228033  0.228499  0.565676  1
  Cu  Cu158  1  0.197381  0.531148  0.587890  1
  Cu  Cu159  1  0.258643  0.925803  0.543349  1
  Cu  Cu160  1  0.530715  0.197814  0.587890  1
  Cu  Cu161  1  0.591976  0.592470  0.543349  1
  Cu  Cu162  1  0.925310  0.259137  0.543349  1
  Cu  Cu163  1  0.758643  0.925803  0.543349  1
  Cu  Cu164  1  0.091976  0.592470  0.543349  1
  Cu  Cu165  1  0.061366  0.895165  0.565676  1
  Cu  Cu166  1  0.425310  0.259137  0.543349  1
  Cu  Cu167  1  0.394700  0.561832  0.565676  1
  Cu  Cu168  1  0.364048  0.864481  0.587890  1
  Cu  Cu169  1  0.728033  0.228499  0.565676  1
  Cu  Cu170  1  0.697381  0.531148  0.587890  1
  Cu  Cu171  1  0.030715  0.197814  0.587890  1
  Cu  Cu172  1  0.591976  0.092470  0.543349  1
  Cu  Cu173  1  0.925310  0.759137  0.543349  1
  Cu  Cu174  1  0.894700  0.061832  0.565676  1
  Cu  Cu175  1  0.258643  0.425803  0.543349  1
  Cu  Cu176  1  0.228033  0.728499  0.565676  1
  Cu  Cu177  1  0.197381  0.031148  0.587890  1
  Cu  Cu178  1  0.561366  0.395165  0.565676  1
  Cu  Cu179  1  0.530715  0.697814  0.587890  1
  Cu  Cu180  1  0.864048  0.364481  0.587890  1
  Cu  Cu181  1  0.605673  0.939363  0.655021  1
  Cu  Cu182  1  0.939006  0.606029  0.655021  1
  Cu  Cu183  1  1.000136  1.000545  0.610299  1
  Cu  Cu184  1  0.272339  0.272696  0.655021  1
  Cu  Cu185  1  0.333470  0.667212  0.610299  1
  Cu  Cu186  1  0.302767  0.969804  0.632380  1
  Cu  Cu187  1  0.666803  0.333879  0.610299  1
  Cu  Cu188  1  0.636101  0.636471  0.632380  1
  Cu  Cu189  1  0.969434  0.303138  0.632380  1
  Cu  Cu190  1  0.469434  0.803138  0.632380  1
  Cu  Cu191  1  0.802767  0.469804  0.632380  1
  Cu  Cu192  1  0.772339  0.772696  0.655021  1
  Cu  Cu193  1  0.136101  0.136471  0.632380  1
  Cu  Cu194  1  0.105673  0.439363  0.655021  1
  Cu  Cu195  1  0.166803  0.833879  0.610299  1
  Cu  Cu196  1  0.439006  0.106029  0.655021  1
  Cu  Cu197  1  0.500136  0.500545  0.610299  1
  Cu  Cu198  1  0.833470  0.167212  0.610299  1
  Cu  Cu199  1  0.666803  0.833879  0.610299  1
  Cu  Cu200  1  1.000136  0.500545  0.610299  1
  Cu  Cu201  1  0.969434  0.803138  0.632380  1
  Cu  Cu202  1  0.333470  0.167212  0.610299  1
  Cu  Cu203  1  0.302767  0.469804  0.632380  1
  Cu  Cu204  1  0.272339  0.772696  0.655021  1
  Cu  Cu205  1  0.636101  0.136471  0.632380  1
  Cu  Cu206  1  0.605673  0.439363  0.655021  1
  Cu  Cu207  1  0.939006  0.106029  0.655021  1
  Cu  Cu208  1  0.500136  1.000545  0.610299  1
  Cu  Cu209  1  0.833470  0.667212  0.610299  1
  Cu  Cu210  1  0.802767  0.969804  0.632380  1
  Cu  Cu211  1  0.166803  0.333879  0.610299  1
  Cu  Cu212  1  0.136101  0.636471  0.632380  1
  Cu  Cu213  1  0.105673  0.939363  0.655021  1
  Cu  Cu214  1  0.469434  0.303138  0.632380  1
  Cu  Cu215  1  0.439006  0.606029  0.655021  1
  Cu  Cu216  1  0.772339  0.272696  0.655021  1
  Cu  Cu217  1  0.511783  0.845354  0.720186  1
  Cu  Cu218  1  0.845116  0.512020  0.720186  1
  Cu  Cu219  1  0.908506  0.908807  0.676741  1
  Cu  Cu220  1  0.178450  0.178687  0.720186  1
  Cu  Cu221  1  0.241840  0.575474  0.676741  1
  Cu  Cu222  1  0.210767  0.877767  0.699715  1
  Cu  Cu223  1  0.575173  0.242140  0.676741  1
  Cu  Cu224  1  0.544101  0.544434  0.699715  1
  Cu  Cu225  1  0.877434  0.211100  0.699715  1
  Cu  Cu226  1  0.377434  0.711100  0.699715  1
  Cu  Cu227  1  0.710767  0.377767  0.699715  1
  Cu  Cu228  1  0.678450  0.678687  0.720186  1
  Cu  Cu229  1  0.044101  0.044434  0.699715  1
  Cu  Cu230  1  0.011783  0.345354  0.720186  1
  Cu  Cu231  1  0.075173  0.742140  0.676741  1
  Cu  Cu232  1  0.345116  0.012020  0.720186  1
  Cu  Cu233  1  0.408506  0.408807  0.676741  1
  Cu  Cu234  1  0.741840  0.075474  0.676741  1
  Cu  Cu235  1  0.575173  0.742140  0.676741  1
  Cu  Cu236  1  0.908506  0.408807  0.676741  1
  Cu  Cu237  1  0.877434  0.711100  0.699715  1
  Cu  Cu238  1  0.241840  0.075474  0.676741  1
  Cu  Cu239  1  0.210767  0.377767  0.699715  1
  Cu  Cu240  1  0.178450  0.678687  0.720186  1
  Cu  Cu241  1  0.544101  0.044434  0.699715  1
  Cu  Cu242  1  0.511783  0.345354  0.720186  1
  Cu  Cu243  1  0.845116  0.012020  0.720186  1
  Cu  Cu244  1  0.408506  0.908807  0.676741  1
  Cu  Cu245  1  0.741840  0.575474  0.676741  1
  Cu  Cu246  1  0.710767  0.877767  0.699715  1
  Cu  Cu247  1  0.075173  0.242140  0.676741  1
  Cu  Cu248  1  0.044101  0.544434  0.699715  1
  Cu  Cu249  1  0.011783  0.845354  0.720186  1
  Cu  Cu250  1  0.377434  0.211100  0.699715  1
  Cu  Cu251  1  0.345116  0.512020  0.720186  1
  Cu  Cu252  1  0.678450  0.178687  0.720186  1
