# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.69544843
_cell_length_b   12.95877554
_cell_length_c   49.20178449
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   92.12295601
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu
_chemical_formula_sum   Cu162
_cell_volume   4266.0535533
_cell_formula_units_Z   162
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  0.554525  0.181944  0.315998  1
  Cu  Cu2  1  0.534987  0.859597  0.299581  1
  Cu  Cu3  1  0.508224  0.537002  0.284210  1
  Cu  Cu4  1  0.887859  0.848611  0.315998  1
  Cu  Cu5  1  0.868320  0.526263  0.299581  1
  Cu  Cu6  1  0.221192  0.515278  0.315998  1
  Cu  Cu7  1  0.841557  0.203669  0.284210  1
  Cu  Cu8  1  0.201653  0.192930  0.299581  1
  Cu  Cu9  1  0.174891  0.870336  0.284210  1
  Cu  Cu10  1  0.634074  0.361424  0.297162  1
  Cu  Cu11  1  0.612415  0.040197  0.282133  1
  Cu  Cu12  1  0.656138  0.681906  0.313710  1
  Cu  Cu13  1  0.967408  0.028091  0.297162  1
  Cu  Cu14  1  0.945748  0.706864  0.282133  1
  Cu  Cu15  1  0.300741  0.694758  0.297162  1
  Cu  Cu16  1  0.989471  0.348573  0.313710  1
  Cu  Cu17  1  0.279082  0.373531  0.282133  1
  Cu  Cu18  1  0.322804  0.015240  0.313710  1
  Cu  Cu19  1  0.621737  0.144072  0.366313  1
  Cu  Cu20  1  0.599668  0.822644  0.349446  1
  Cu  Cu21  1  0.577413  0.501323  0.332725  1
  Cu  Cu22  1  0.955070  0.810739  0.366313  1
  Cu  Cu23  1  0.933002  0.489311  0.349446  1
  Cu  Cu24  1  0.288404  0.477406  0.366313  1
  Cu  Cu25  1  0.910746  0.167989  0.332725  1
  Cu  Cu26  1  0.266335  0.155977  0.349446  1
  Cu  Cu27  1  0.244079  0.834656  0.332725  1
  Cu  Cu28  1  0.704600  0.324498  0.346901  1
  Cu  Cu29  1  0.680208  0.004387  0.330640  1
  Cu  Cu30  1  0.726929  0.645521  0.363757  1
  Cu  Cu31  1  0.037933  0.991164  0.346901  1
  Cu  Cu32  1  0.013541  0.671054  0.330640  1
  Cu  Cu33  1  0.371267  0.657831  0.346901  1
  Cu  Cu34  1  0.060262  0.312187  0.363757  1
  Cu  Cu35  1  0.346875  0.337721  0.330640  1
  Cu  Cu36  1  0.393595  0.978854  0.363757  1
  Cu  Cu37  1  0.690219  0.107047  0.416383  1
  Cu  Cu38  1  0.667295  0.785975  0.399670  1
  Cu  Cu39  1  0.644648  0.464832  0.382936  1
  Cu  Cu40  1  0.023553  0.773713  0.416383  1
  Cu  Cu41  1  1.000628  0.452642  0.399670  1
  Cu  Cu42  1  0.356886  0.440380  0.416383  1
  Cu  Cu43  1  0.977982  0.131499  0.382936  1
  Cu  Cu44  1  0.333962  0.119308  0.399670  1
  Cu  Cu45  1  0.311315  0.798165  0.382936  1
  Cu  Cu46  1  0.773043  0.287894  0.397095  1
  Cu  Cu47  1  0.750225  0.966781  0.380431  1
  Cu  Cu48  1  0.795910  0.608944  0.413793  1
  Cu  Cu49  1  0.106376  0.954561  0.397095  1
  Cu  Cu50  1  0.083558  0.633448  0.380431  1
  Cu  Cu51  1  0.439710  0.621227  0.397095  1
  Cu  Cu52  1  0.129244  0.275610  0.413793  1
  Cu  Cu53  1  0.416891  0.300115  0.380431  1
  Cu  Cu54  1  0.462577  0.942277  0.413793  1
  Cu  Cu55  1  0.758805  0.070269  0.466472  1
  Cu  Cu56  1  0.735910  0.749196  0.449774  1
  Cu  Cu57  1  0.713037  0.428121  0.433072  1
  Cu  Cu58  1  0.092139  0.736935  0.466472  1
  Cu  Cu59  1  0.069243  0.415862  0.449774  1
  Cu  Cu60  1  0.425472  0.403602  0.466472  1
  Cu  Cu61  1  0.046371  0.094787  0.433072  1
  Cu  Cu62  1  0.402576  0.082529  0.449774  1
  Cu  Cu63  1  0.379704  0.761454  0.433072  1
  Cu  Cu64  1  0.841709  0.251117  0.447165  1
  Cu  Cu65  1  0.818836  0.930020  0.430474  1
  Cu  Cu66  1  0.864606  0.572193  0.463856  1
  Cu  Cu67  1  0.175042  0.917784  0.447165  1
  Cu  Cu68  1  0.152169  0.596687  0.430474  1
  Cu  Cu69  1  0.508376  0.584450  0.447165  1
  Cu  Cu70  1  0.197939  0.238860  0.463856  1
  Cu  Cu71  1  0.485502  0.263354  0.430474  1
  Cu  Cu72  1  0.531273  0.905526  0.463856  1
  Cu  Cu73  1  0.827481  0.033507  0.516552  1
  Cu  Cu74  1  0.804585  0.712426  0.499859  1
  Cu  Cu75  1  0.781692  0.391349  0.483165  1
  Cu  Cu76  1  0.160814  0.700174  0.516552  1
  Cu  Cu77  1  0.137918  0.379093  0.499859  1
  Cu  Cu78  1  0.494148  0.366840  0.516552  1
  Cu  Cu79  1  0.115025  0.058016  0.483165  1
  Cu  Cu80  1  0.471252  0.045760  0.499859  1
  Cu  Cu81  1  0.448358  0.724683  0.483165  1
  Cu  Cu82  1  0.910396  0.214352  0.497240  1
  Cu  Cu83  1  0.887500  0.893271  0.480547  1
  Cu  Cu84  1  0.933289  0.535429  0.513934  1
  Cu  Cu85  1  0.243729  0.881019  0.497240  1
  Cu  Cu86  1  0.220833  0.559938  0.480547  1
  Cu  Cu87  1  0.577062  0.547686  0.497240  1
  Cu  Cu88  1  0.266622  0.202096  0.513934  1
  Cu  Cu89  1  0.554166  0.226605  0.480547  1
  Cu  Cu90  1  0.599956  0.868762  0.513934  1
  Cu  Cu91  1  0.896145  0.996758  0.566625  1
  Cu  Cu92  1  0.873272  0.675661  0.549933  1
  Cu  Cu93  1  0.850375  0.354586  0.533243  1
  Cu  Cu94  1  0.229478  0.663425  0.566625  1
  Cu  Cu95  1  0.206605  0.342328  0.549933  1
  Cu  Cu96  1  0.562812  0.330091  0.566625  1
  Cu  Cu97  1  0.183708  0.021252  0.533243  1
  Cu  Cu98  1  0.539938  0.008995  0.549933  1
  Cu  Cu99  1  0.517041  0.687919  0.533243  1
  Cu  Cu100  1  0.979071  0.177583  0.547325  1
  Cu  Cu101  1  0.956175  0.856510  0.530627  1
  Cu  Cu102  1  1.001943  0.498658  0.564026  1
  Cu  Cu103  1  0.312404  0.844249  0.547325  1
  Cu  Cu104  1  0.289509  0.523177  0.530627  1
  Cu  Cu105  1  0.645738  0.510916  0.547325  1
  Cu  Cu106  1  0.335277  0.165324  0.564026  1
  Cu  Cu107  1  0.622842  0.189843  0.530627  1
  Cu  Cu108  1  0.668610  0.831991  0.564026  1
  Cu  Cu109  1  0.964756  0.959997  0.616668  1
  Cu  Cu110  1  0.941938  0.638884  0.600004  1
  Cu  Cu111  1  0.919071  0.317835  0.583306  1
  Cu  Cu112  1  0.298089  0.626664  0.616668  1
  Cu  Cu113  1  0.275271  0.305551  0.600004  1
  Cu  Cu114  1  0.631423  0.293330  0.616668  1
  Cu  Cu115  1  0.252404  0.984501  0.583306  1
  Cu  Cu116  1  0.608604  0.972218  0.600004  1
  Cu  Cu117  1  0.585737  0.651168  0.583306  1
  Cu  Cu118  1  0.047686  0.140803  0.597429  1
  Cu  Cu119  1  0.024761  0.819732  0.580715  1
  Cu  Cu120  1  0.070333  0.461947  0.614163  1
  Cu  Cu121  1  0.381019  0.807470  0.597429  1
  Cu  Cu122  1  0.358095  0.486398  0.580715  1
  Cu  Cu123  1  0.714352  0.474137  0.597429  1
  Cu  Cu124  1  0.403666  0.128613  0.614163  1
  Cu  Cu125  1  0.691428  0.153065  0.580715  1
  Cu  Cu126  1  0.736999  0.795280  0.614163  1
  Cu  Cu127  1  0.034773  0.922391  0.666459  1
  Cu  Cu128  1  0.010381  0.602281  0.650197  1
  Cu  Cu129  1  0.988052  0.281258  0.633341  1
  Cu  Cu130  1  0.368106  0.589058  0.666459  1
  Cu  Cu131  1  0.343714  0.268948  0.650197  1
  Cu  Cu132  1  0.701439  0.255724  0.666459  1
  Cu  Cu133  1  0.321385  0.947924  0.633341  1
  Cu  Cu134  1  0.677048  0.935614  0.650197  1
  Cu  Cu135  1  0.654719  0.614591  0.633341  1
  Cu  Cu136  1  0.115312  0.104134  0.647653  1
  Cu  Cu137  1  0.093244  0.782706  0.630786  1
  Cu  Cu138  1  0.137568  0.425456  0.664374  1
  Cu  Cu139  1  0.448646  0.770801  0.647653  1
  Cu  Cu140  1  0.426577  0.449373  0.630786  1
  Cu  Cu141  1  0.781979  0.437468  0.647653  1
  Cu  Cu142  1  0.470901  0.092122  0.664374  1
  Cu  Cu143  1  0.759910  0.116039  0.630786  1
  Cu  Cu144  1  0.804235  0.758789  0.664374  1
  Cu  Cu145  1  0.102566  0.886581  0.714966  1
  Cu  Cu146  1  0.080907  0.565354  0.699937  1
  Cu  Cu147  1  0.058843  0.244872  0.683389  1
  Cu  Cu148  1  0.435899  0.553248  0.714966  1
  Cu  Cu149  1  0.414240  0.232021  0.699937  1
  Cu  Cu150  1  0.769232  0.219915  0.714966  1
  Cu  Cu151  1  0.392176  0.911539  0.683389  1
  Cu  Cu152  1  0.747573  0.898687  0.699937  1
  Cu  Cu153  1  0.725510  0.578205  0.683389  1
  Cu  Cu154  1  0.179994  0.067182  0.697518  1
  Cu  Cu155  1  0.160455  0.744834  0.681101  1
  Cu  Cu156  1  0.206757  0.389776  0.712889  1
  Cu  Cu157  1  0.513327  0.733848  0.697518  1
  Cu  Cu158  1  0.493789  0.411501  0.681101  1
  Cu  Cu159  1  0.846661  0.400515  0.697518  1
  Cu  Cu160  1  0.540090  0.056443  0.712889  1
  Cu  Cu161  1  0.827122  0.078167  0.681101  1
  Cu  Cu162  1  0.873423  0.723109  0.712889  1
