# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.49553019
_cell_length_b   12.21169841
_cell_length_c   47.68477569
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   92.17660723
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu
_chemical_formula_sum   Cu162
_cell_volume   3779.69682239
_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  0.484780  0.367346  0.278658  1
  Cu  Cu2  1  0.532750  0.009876  0.308223  1
  Cu  Cu3  1  0.509157  0.690341  0.292430  1
  Cu  Cu4  1  0.818113  0.034013  0.278658  1
  Cu  Cu5  1  0.866083  0.676543  0.308223  1
  Cu  Cu6  1  0.151447  0.700679  0.278658  1
  Cu  Cu7  1  0.842491  0.357007  0.292430  1
  Cu  Cu8  1  0.199416  0.343210  0.308223  1
  Cu  Cu9  1  0.175824  0.023674  0.292430  1
  Cu  Cu10  1  0.618457  0.192061  0.289575  1
  Cu  Cu11  1  0.664539  0.834526  0.321245  1
  Cu  Cu12  1  0.641581  0.513418  0.305062  1
  Cu  Cu13  1  0.951790  0.858728  0.289575  1
  Cu  Cu14  1  0.997872  0.501193  0.321245  1
  Cu  Cu15  1  0.285123  0.525395  0.289575  1
  Cu  Cu16  1  0.974915  0.180085  0.305062  1
  Cu  Cu17  1  0.331205  0.167859  0.321245  1
  Cu  Cu18  1  0.308248  0.846752  0.305062  1
  Cu  Cu19  1  0.560824  0.330741  0.325628  1
  Cu  Cu20  1  0.606040  0.972029  0.357852  1
  Cu  Cu21  1  0.582920  0.651723  0.341253  1
  Cu  Cu22  1  0.894157  0.997407  0.325628  1
  Cu  Cu23  1  0.939374  0.638696  0.357852  1
  Cu  Cu24  1  0.227491  0.664074  0.325628  1
  Cu  Cu25  1  0.916253  0.318390  0.341253  1
  Cu  Cu26  1  0.272707  0.305362  0.357852  1
  Cu  Cu27  1  0.249587  0.985056  0.341253  1
  Cu  Cu28  1  0.689456  0.153101  0.338176  1
  Cu  Cu29  1  0.735565  0.794903  0.371503  1
  Cu  Cu30  1  0.712759  0.474681  0.354917  1
  Cu  Cu31  1  0.022789  0.819768  0.338176  1
  Cu  Cu32  1  0.068899  0.461569  0.371503  1
  Cu  Cu33  1  0.356123  0.486435  0.338176  1
  Cu  Cu34  1  0.046093  0.141347  0.354917  1
  Cu  Cu35  1  0.402232  0.128236  0.371503  1
  Cu  Cu36  1  0.379426  0.808014  0.354917  1
  Cu  Cu37  1  0.630771  0.292182  0.374762  1
  Cu  Cu38  1  0.676915  0.933237  0.407976  1
  Cu  Cu39  1  0.653834  0.613021  0.391274  1
  Cu  Cu40  1  0.964105  0.958848  0.374762  1
  Cu  Cu41  1  0.010249  0.599904  0.407976  1
  Cu  Cu42  1  0.297438  0.625515  0.374762  1
  Cu  Cu43  1  0.987167  0.279688  0.391274  1
  Cu  Cu44  1  0.343582  0.266570  0.407976  1
  Cu  Cu45  1  0.320500  0.946355  0.391274  1
  Cu  Cu46  1  0.759044  0.114866  0.388446  1
  Cu  Cu47  1  0.805301  0.755895  0.421938  1
  Cu  Cu48  1  0.782271  0.435546  0.405224  1
  Cu  Cu49  1  0.092377  0.781533  0.388446  1
  Cu  Cu50  1  0.138635  0.422562  0.421938  1
  Cu  Cu51  1  0.425710  0.448199  0.388446  1
  Cu  Cu52  1  0.115605  0.102213  0.405224  1
  Cu  Cu53  1  0.471968  0.089229  0.421938  1
  Cu  Cu54  1  0.448938  0.768879  0.405224  1
  Cu  Cu55  1  0.700291  0.253687  0.424756  1
  Cu  Cu56  1  0.746291  0.894536  0.458176  1
  Cu  Cu57  1  0.723278  0.574180  0.441445  1
  Cu  Cu58  1  0.033624  0.920353  0.424756  1
  Cu  Cu59  1  0.079624  0.561203  0.458176  1
  Cu  Cu60  1  0.366957  0.587020  0.424756  1
  Cu  Cu61  1  0.056612  0.240847  0.441445  1
  Cu  Cu62  1  0.412958  0.227870  0.458176  1
  Cu  Cu63  1  0.389945  0.907513  0.441445  1
  Cu  Cu64  1  0.828392  0.076189  0.438733  1
  Cu  Cu65  1  0.874473  0.717040  0.472226  1
  Cu  Cu66  1  0.851474  0.396656  0.455489  1
  Cu  Cu67  1  0.161726  0.742855  0.438733  1
  Cu  Cu68  1  0.207806  0.383707  0.472226  1
  Cu  Cu69  1  0.495059  0.409522  0.438733  1
  Cu  Cu70  1  0.184808  0.063323  0.455489  1
  Cu  Cu71  1  0.541139  0.050373  0.472226  1
  Cu  Cu72  1  0.518141  0.729990  0.455489  1
  Cu  Cu73  1  0.769362  0.214940  0.474927  1
  Cu  Cu74  1  0.815356  0.855759  0.508403  1
  Cu  Cu75  1  0.792348  0.535357  0.491659  1
  Cu  Cu76  1  0.102695  0.881607  0.474927  1
  Cu  Cu77  1  0.148690  0.522426  0.508403  1
  Cu  Cu78  1  0.436028  0.548274  0.474927  1
  Cu  Cu79  1  0.125681  0.202024  0.491659  1
  Cu  Cu80  1  0.482023  0.189093  0.508403  1
  Cu  Cu81  1  0.459015  0.868691  0.491659  1
  Cu  Cu82  1  0.897497  0.037413  0.488983  1
  Cu  Cu83  1  0.943491  0.678232  0.522459  1
  Cu  Cu84  1  0.920505  0.357815  0.505726  1
  Cu  Cu85  1  0.230830  0.704080  0.488983  1
  Cu  Cu86  1  0.276825  0.344898  0.522459  1
  Cu  Cu87  1  0.564163  0.370746  0.488983  1
  Cu  Cu88  1  0.253839  0.024482  0.505726  1
  Cu  Cu89  1  0.610158  0.011565  0.522459  1
  Cu  Cu90  1  0.587172  0.691148  0.505726  1
  Cu  Cu91  1  0.838380  0.176132  0.525160  1
  Cu  Cu92  1  0.884461  0.816984  0.558653  1
  Cu  Cu93  1  0.861379  0.496516  0.541897  1
  Cu  Cu94  1  0.171714  0.842799  0.525160  1
  Cu  Cu95  1  0.217794  0.483650  0.558653  1
  Cu  Cu96  1  0.505047  0.509466  0.525160  1
  Cu  Cu97  1  0.194712  0.163183  0.541897  1
  Cu  Cu98  1  0.551127  0.150317  0.558653  1
  Cu  Cu99  1  0.528045  0.829849  0.541897  1
  Cu  Cu100  1  0.966562  0.998636  0.539210  1
  Cu  Cu101  1  0.012562  0.639485  0.572630  1
  Cu  Cu102  1  0.989575  0.318992  0.555941  1
  Cu  Cu103  1  0.299895  0.665302  0.539210  1
  Cu  Cu104  1  0.345896  0.306152  0.572630  1
  Cu  Cu105  1  0.633229  0.331969  0.539210  1
  Cu  Cu106  1  0.322908  0.985659  0.555941  1
  Cu  Cu107  1  0.679229  0.972819  0.572630  1
  Cu  Cu108  1  0.656241  0.652326  0.555941  1
  Cu  Cu109  1  0.907552  0.137277  0.575448  1
  Cu  Cu110  1  0.953809  0.778306  0.608940  1
  Cu  Cu111  1  0.930582  0.457626  0.592162  1
  Cu  Cu112  1  0.240885  0.803944  0.575448  1
  Cu  Cu113  1  0.287143  0.444973  0.608940  1
  Cu  Cu114  1  0.574218  0.470610  0.575448  1
  Cu  Cu115  1  0.263915  0.124293  0.592162  1
  Cu  Cu116  1  0.620476  0.111639  0.608940  1
  Cu  Cu117  1  0.597248  0.790959  0.592162  1
  Cu  Cu118  1  0.035938  0.959935  0.589410  1
  Cu  Cu119  1  0.082082  0.600990  0.622624  1
  Cu  Cu120  1  0.059019  0.280151  0.606112  1
  Cu  Cu121  1  0.369271  0.626602  0.589410  1
  Cu  Cu122  1  0.415415  0.267657  0.622624  1
  Cu  Cu123  1  0.702604  0.293269  0.589410  1
  Cu  Cu124  1  0.392353  0.946818  0.606112  1
  Cu  Cu125  1  0.748748  0.934324  0.622624  1
  Cu  Cu126  1  0.725686  0.613484  0.606112  1
  Cu  Cu127  1  0.977288  0.098270  0.625883  1
  Cu  Cu128  1  0.023397  0.740071  0.659210  1
  Cu  Cu129  1  1.000094  0.418491  0.642469  1
  Cu  Cu130  1  0.310621  0.764936  0.625883  1
  Cu  Cu131  1  0.356730  0.406738  0.659210  1
  Cu  Cu132  1  0.643954  0.431603  0.625883  1
  Cu  Cu133  1  0.333427  0.085158  0.642469  1
  Cu  Cu134  1  0.690064  0.073404  0.659210  1
  Cu  Cu135  1  0.666760  0.751825  0.642469  1
  Cu  Cu136  1  0.106813  0.921143  0.639534  1
  Cu  Cu137  1  0.152029  0.562432  0.671758  1
  Cu  Cu138  1  0.129933  0.241449  0.656133  1
  Cu  Cu139  1  0.440146  0.587810  0.639534  1
  Cu  Cu140  1  0.485362  0.229098  0.671758  1
  Cu  Cu141  1  0.773479  0.254476  0.639534  1
  Cu  Cu142  1  0.463266  0.908116  0.656133  1
  Cu  Cu143  1  0.818696  0.895765  0.671758  1
  Cu  Cu144  1  0.796600  0.574783  0.656133  1
  Cu  Cu145  1  0.048314  0.058646  0.676141  1
  Cu  Cu146  1  0.094396  0.701111  0.707811  1
  Cu  Cu147  1  0.071272  0.379754  0.692324  1
  Cu  Cu148  1  0.381648  0.725313  0.676141  1
  Cu  Cu149  1  0.427730  0.367777  0.707811  1
  Cu  Cu150  1  0.714981  0.391979  0.676141  1
  Cu  Cu151  1  0.404605  0.046421  0.692324  1
  Cu  Cu152  1  0.761063  0.034444  0.707811  1
  Cu  Cu153  1  0.737938  0.713087  0.692324  1
  Cu  Cu154  1  0.180103  0.883296  0.689163  1
  Cu  Cu155  1  0.228073  0.525826  0.718728  1
  Cu  Cu156  1  0.203696  0.202832  0.704956  1
  Cu  Cu157  1  0.513437  0.549962  0.689163  1
  Cu  Cu158  1  0.561406  0.192493  0.718728  1
  Cu  Cu159  1  0.846770  0.216629  0.689163  1
  Cu  Cu160  1  0.537029  0.869498  0.704956  1
  Cu  Cu161  1  0.894740  0.859160  0.718728  1
  Cu  Cu162  1  0.870362  0.536165  0.704956  1
