# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.29556441
_cell_length_b   11.04573215
_cell_length_c   47.45110956
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu
_chemical_formula_sum   Cu168
_cell_volume   4347.97281094
_cell_formula_units_Z   168
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  1.002024  0.633809  0.295893  1
  Cu  Cu2  1  0.002837  0.419691  0.276600  1
  Cu  Cu3  1  1.002510  0.028869  0.286044  1
  Cu  Cu4  1  0.752522  0.373954  0.303164  1
  Cu  Cu5  1  0.752522  0.164190  0.282537  1
  Cu  Cu6  1  0.752522  0.769113  0.292617  1
  Cu  Cu7  1  0.503020  0.633809  0.295893  1
  Cu  Cu8  1  0.502207  0.419691  0.276600  1
  Cu  Cu9  1  0.502534  0.028869  0.286044  1
  Cu  Cu10  1  0.252522  0.500704  0.299535  1
  Cu  Cu11  1  0.252522  0.287781  0.279330  1
  Cu  Cu12  1  0.252522  0.894020  0.289578  1
  Cu  Cu13  1  0.003444  0.449854  0.328506  1
  Cu  Cu14  1  1.002421  0.237680  0.307178  1
  Cu  Cu15  1  1.002425  0.844105  0.317176  1
  Cu  Cu16  1  0.752522  0.188216  0.335293  1
  Cu  Cu17  1  0.752522  0.978711  0.313551  1
  Cu  Cu18  1  0.752522  0.583021  0.323388  1
  Cu  Cu19  1  0.501600  0.449854  0.328506  1
  Cu  Cu20  1  0.502623  0.237680  0.307178  1
  Cu  Cu21  1  0.502618  0.844105  0.317176  1
  Cu  Cu22  1  0.252522  0.316705  0.331725  1
  Cu  Cu23  1  0.252522  0.103863  0.310386  1
  Cu  Cu24  1  0.252522  0.709720  0.320753  1
  Cu  Cu25  1  0.002574  0.265171  0.360408  1
  Cu  Cu26  1  1.002419  0.054007  0.338922  1
  Cu  Cu27  1  1.001970  0.660117  0.349214  1
  Cu  Cu28  1  0.752522  1.003451  0.367278  1
  Cu  Cu29  1  0.752522  0.793255  0.345562  1
  Cu  Cu30  1  0.752522  0.398936  0.356481  1
  Cu  Cu31  1  0.502469  0.265171  0.360408  1
  Cu  Cu32  1  0.502624  0.054007  0.338922  1
  Cu  Cu33  1  0.503073  0.660117  0.349214  1
  Cu  Cu34  1  0.252522  0.131889  0.363858  1
  Cu  Cu35  1  0.252522  0.920664  0.342403  1
  Cu  Cu36  1  0.252522  0.527177  0.353201  1
  Cu  Cu37  1  0.002536  0.080808  0.392609  1
  Cu  Cu38  1  1.002429  0.870034  0.370894  1
  Cu  Cu39  1  0.002574  0.476065  0.381916  1
  Cu  Cu40  1  0.752522  0.819425  0.399524  1
  Cu  Cu41  1  0.752522  0.609100  0.377674  1
  Cu  Cu42  1  0.752522  0.214320  0.388950  1
  Cu  Cu43  1  0.502508  0.080808  0.392609  1
  Cu  Cu44  1  0.502614  0.870034  0.370894  1
  Cu  Cu45  1  0.502469  0.476065  0.381916  1
  Cu  Cu46  1  0.252522  0.947503  0.396201  1
  Cu  Cu47  1  0.252522  0.736900  0.374549  1
  Cu  Cu48  1  0.252522  0.342681  0.385536  1
  Cu  Cu49  1  1.002506  0.896685  0.424849  1
  Cu  Cu50  1  1.002452  0.686278  0.403238  1
  Cu  Cu51  1  0.002552  0.291616  0.414196  1
  Cu  Cu52  1  0.752522  0.635433  0.431823  1
  Cu  Cu53  1  0.752522  0.425065  0.410375  1
  Cu  Cu54  1  0.752522  0.030014  0.421190  1
  Cu  Cu55  1  0.502537  0.896685  0.424849  1
  Cu  Cu56  1  0.502592  0.686278  0.403238  1
  Cu  Cu57  1  0.502492  0.291616  0.414196  1
  Cu  Cu58  1  0.252522  0.763470  0.428569  1
  Cu  Cu59  1  0.252522  0.553150  0.407120  1
  Cu  Cu60  1  0.252522  0.158220  0.417804  1
  Cu  Cu61  1  1.002507  0.712656  0.457209  1
  Cu  Cu62  1  0.002529  0.502218  0.435732  1
  Cu  Cu63  1  0.002534  0.107325  0.446462  1
  Cu  Cu64  1  0.752522  0.451361  0.464296  1
  Cu  Cu65  1  0.752522  0.240745  0.442776  1
  Cu  Cu66  1  0.752522  0.845893  0.453466  1
  Cu  Cu67  1  0.502536  0.712656  0.457209  1
  Cu  Cu68  1  0.502515  0.502218  0.435732  1
  Cu  Cu69  1  0.502510  0.107325  0.446462  1
  Cu  Cu70  1  0.252522  0.579418  0.461004  1
  Cu  Cu71  1  0.252522  0.368853  0.439430  1
  Cu  Cu72  1  0.252522  0.973976  0.450139  1
  Cu  Cu73  1  0.002523  0.528567  0.489615  1
  Cu  Cu74  1  0.002530  0.317974  0.468051  1
  Cu  Cu75  1  0.002528  0.923144  0.478770  1
  Cu  Cu76  1  0.752522  0.267150  0.496648  1
  Cu  Cu77  1  0.752522  0.056495  0.475065  1
  Cu  Cu78  1  0.752522  0.661839  0.485819  1
  Cu  Cu79  1  0.502521  0.528567  0.489615  1
  Cu  Cu80  1  0.502514  0.317974  0.468051  1
  Cu  Cu81  1  0.502516  0.923144  0.478770  1
  Cu  Cu82  1  0.252522  0.395196  0.493313  1
  Cu  Cu83  1  0.252522  0.184571  0.471720  1
  Cu  Cu84  1  0.252522  0.789867  0.482532  1
  Cu  Cu85  1  0.002532  0.344375  0.521929  1
  Cu  Cu86  1  0.002536  0.133734  0.500341  1
  Cu  Cu87  1  0.002523  0.739053  0.511164  1
  Cu  Cu88  1  0.752522  0.082910  0.528934  1
  Cu  Cu89  1  0.752522  0.872315  0.507370  1
  Cu  Cu90  1  0.752522  0.477761  0.518219  1
  Cu  Cu91  1  0.502512  0.344375  0.521929  1
  Cu  Cu92  1  0.502508  0.133734  0.500341  1
  Cu  Cu93  1  0.502520  0.739053  0.511164  1
  Cu  Cu94  1  0.252522  0.210948  0.525617  1
  Cu  Cu95  1  0.252522  1.000355  0.504072  1
  Cu  Cu96  1  0.252522  0.605762  0.514905  1
  Cu  Cu97  1  0.002551  0.160122  0.554214  1
  Cu  Cu98  1  0.002543  0.949523  0.532680  1
  Cu  Cu99  1  0.002529  0.554961  0.543529  1
  Cu  Cu100  1  0.752522  0.898665  0.561233  1
  Cu  Cu101  1  0.752522  0.688237  0.539775  1
  Cu  Cu102  1  0.752522  0.293589  0.550528  1
  Cu  Cu103  1  0.502492  0.160122  0.554214  1
  Cu  Cu104  1  0.502501  0.949523  0.532680  1
  Cu  Cu105  1  0.502515  0.554961  0.543529  1
  Cu  Cu106  1  0.252522  0.026683  0.557992  1
  Cu  Cu107  1  0.252522  0.816221  0.536497  1
  Cu  Cu108  1  0.252522  0.421567  0.547196  1
  Cu  Cu109  1  0.002581  0.975847  0.586573  1
  Cu  Cu110  1  1.002520  0.765445  0.565140  1
  Cu  Cu111  1  0.002548  0.370765  0.575823  1
  Cu  Cu112  1  0.752522  0.714588  0.593741  1
  Cu  Cu113  1  0.752522  0.504197  0.572156  1
  Cu  Cu114  1  0.752522  0.109337  0.582774  1
  Cu  Cu115  1  0.502462  0.975847  0.586573  1
  Cu  Cu116  1  0.502523  0.765445  0.565140  1
  Cu  Cu117  1  0.502496  0.370765  0.575823  1
  Cu  Cu118  1  0.252522  0.842521  0.590504  1
  Cu  Cu119  1  0.252522  0.632143  0.568826  1
  Cu  Cu120  1  0.252522  0.237282  0.579499  1
  Cu  Cu121  1  1.002516  0.791964  0.619199  1
  Cu  Cu122  1  0.002534  0.581376  0.597464  1
  Cu  Cu123  1  0.002598  0.186391  0.608070  1
  Cu  Cu124  1  0.752522  0.530576  0.626151  1
  Cu  Cu125  1  0.752522  0.320040  0.604399  1
  Cu  Cu126  1  0.752522  0.925025  0.614987  1
  Cu  Cu127  1  0.502528  0.791964  0.619199  1
  Cu  Cu128  1  0.502509  0.581376  0.597464  1
  Cu  Cu129  1  0.502445  0.186391  0.608070  1
  Cu  Cu130  1  0.252522  0.658686  0.622786  1
  Cu  Cu131  1  0.252522  0.447992  0.601064  1
  Cu  Cu132  1  0.252522  0.052801  0.611890  1
  Cu  Cu133  1  0.002635  0.608027  0.651281  1
  Cu  Cu134  1  0.002561  0.397061  0.629747  1
  Cu  Cu135  1  0.002969  1.001961  0.640477  1
  Cu  Cu136  1  0.752522  0.346336  0.658196  1
  Cu  Cu137  1  0.752522  0.135866  0.636587  1
  Cu  Cu138  1  0.752522  0.741018  0.647671  1
  Cu  Cu139  1  0.502409  0.608027  0.651281  1
  Cu  Cu140  1  0.502483  0.397061  0.629747  1
  Cu  Cu141  1  0.502075  1.001961  0.640477  1
  Cu  Cu142  1  0.252522  0.474686  0.654779  1
  Cu  Cu143  1  0.252522  0.263658  0.633346  1
  Cu  Cu144  1  0.252522  0.868326  0.644638  1
  Cu  Cu145  1  1.002396  0.423713  0.683221  1
  Cu  Cu146  1  0.002801  0.212080  0.661819  1
  Cu  Cu147  1  1.001708  0.818390  0.673204  1
  Cu  Cu148  1  0.752522  0.163083  0.690042  1
  Cu  Cu149  1  0.752522  0.951865  0.668193  1
  Cu  Cu150  1  0.752522  0.557996  0.679770  1
  Cu  Cu151  1  0.502648  0.423713  0.683221  1
  Cu  Cu152  1  0.502242  0.212080  0.661819  1
  Cu  Cu153  1  0.503335  0.818390  0.673204  1
  Cu  Cu154  1  0.252522  0.290405  0.686663  1
  Cu  Cu155  1  0.252522  0.078608  0.665539  1
  Cu  Cu156  1  0.252522  0.683694  0.676609  1
  Cu  Cu157  1  1.001421  0.239278  0.714298  1
  Cu  Cu158  1  0.003652  0.027289  0.694033  1
  Cu  Cu159  1  1.002425  0.633351  0.704180  1
  Cu  Cu160  1  0.752522  0.978968  0.719980  1
  Cu  Cu161  1  0.752522  0.768097  0.700901  1
  Cu  Cu162  1  0.752522  0.373958  0.710916  1
  Cu  Cu163  1  0.503623  0.239278  0.714298  1
  Cu  Cu164  1  0.501391  0.027289  0.694033  1
  Cu  Cu165  1  0.502618  0.633351  0.704180  1
  Cu  Cu166  1  0.252522  0.109127  0.717527  1
  Cu  Cu167  1  0.252522  0.893059  0.698122  1
  Cu  Cu168  1  0.252522  0.498742  0.707692  1
