# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.66087771
_cell_length_b   10.66212721
_cell_length_c   47.21510210
_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   5106.46215648
_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  0.782476  0.115805  0.286690  1
  Cu  Cu2  1  0.116780  0.782963  0.285188  1
  Cu  Cu3  1  0.026723  0.026877  0.312586  1
  Cu  Cu4  1  0.403486  0.071564  0.299488  1
  Cu  Cu5  1  0.738216  0.736833  0.299491  1
  Cu  Cu6  1  0.071308  0.404659  0.299001  1
  Cu  Cu7  1  0.449627  0.450114  0.285188  1
  Cu  Cu8  1  0.359495  0.692851  0.312514  1
  Cu  Cu9  1  0.693520  0.360081  0.312585  1
  Cu  Cu10  1  0.505826  0.839192  0.320033  1
  Cu  Cu11  1  0.970139  0.641987  0.279443  1
  Cu  Cu12  1  0.884897  0.879314  0.305864  1
  Cu  Cu13  1  0.260483  0.925930  0.292817  1
  Cu  Cu14  1  0.592586  0.593821  0.292816  1
  Cu  Cu15  1  0.925537  0.258880  0.292410  1
  Cu  Cu16  1  0.308658  0.303463  0.279446  1
  Cu  Cu17  1  0.214317  0.547669  0.305142  1
  Cu  Cu18  1  0.545963  0.218252  0.305866  1
  Cu  Cu19  1  0.654522  0.987891  0.326260  1
  Cu  Cu20  1  0.988620  0.654519  0.329055  1
  Cu  Cu21  1  0.909601  0.909630  0.358829  1
  Cu  Cu22  1  0.282209  0.949656  0.343223  1
  Cu  Cu23  1  0.616271  0.615594  0.343222  1
  Cu  Cu24  1  0.948983  0.282368  0.342888  1
  Cu  Cu25  1  0.321144  0.321996  0.329056  1
  Cu  Cu26  1  0.242840  0.576235  0.358840  1
  Cu  Cu27  1  0.576232  0.242999  0.358832  1
  Cu  Cu28  1  0.389592  0.722993  0.366117  1
  Cu  Cu29  1  0.841286  0.507804  0.318937  1
  Cu  Cu30  1  0.761354  0.764186  0.350790  1
  Cu  Cu31  1  0.135033  0.801941  0.335683  1
  Cu  Cu32  1  0.468563  0.468410  0.335683  1
  Cu  Cu33  1  0.802162  0.135544  0.336225  1
  Cu  Cu34  1  0.174441  0.174651  0.318937  1
  Cu  Cu35  1  0.095572  0.428967  0.351470  1
  Cu  Cu36  1  0.430790  0.094749  0.350787  1
  Cu  Cu37  1  0.536312  0.869718  0.373686  1
  Cu  Cu38  1  0.869485  0.536932  0.373546  1
  Cu  Cu39  1  0.791071  0.792268  0.404132  1
  Cu  Cu40  1  0.164274  0.830989  0.389034  1
  Cu  Cu41  1  0.497581  0.497683  0.389034  1
  Cu  Cu42  1  0.830566  0.163975  0.388996  1
  Cu  Cu43  1  0.203528  0.202888  0.373546  1
  Cu  Cu44  1  0.124810  0.458228  0.404518  1
  Cu  Cu45  1  0.458852  0.124487  0.404131  1
  Cu  Cu46  1  0.272077  0.605496  0.411927  1
  Cu  Cu47  1  0.723187  0.389863  0.366234  1
  Cu  Cu48  1  0.644750  0.644524  0.396464  1
  Cu  Cu49  1  0.017101  0.683525  0.381676  1
  Cu  Cu50  1  0.350118  0.350507  0.381676  1
  Cu  Cu51  1  0.683317  0.016720  0.380918  1
  Cu  Cu52  1  0.056463  0.056586  0.366234  1
  Cu  Cu53  1  0.977960  0.311373  0.396304  1
  Cu  Cu54  1  0.311111  0.978163  0.396464  1
  Cu  Cu55  1  0.419069  0.752492  0.419395  1
  Cu  Cu56  1  0.752528  0.419123  0.419400  1
  Cu  Cu57  1  0.673792  0.673931  0.449855  1
  Cu  Cu58  1  0.046376  0.713126  0.434763  1
  Cu  Cu59  1  0.379696  0.379806  0.434764  1
  Cu  Cu60  1  0.712957  0.046386  0.434576  1
  Cu  Cu61  1  0.085700  0.085951  0.419400  1
  Cu  Cu62  1  0.007121  0.340558  0.449749  1
  Cu  Cu63  1  0.340493  0.007229  0.449855  1
  Cu  Cu64  1  0.154122  0.487563  0.457601  1
  Cu  Cu65  1  0.605220  0.272197  0.411924  1
  Cu  Cu66  1  0.526814  0.526918  0.442281  1
  Cu  Cu67  1  0.899042  0.566461  0.427013  1
  Cu  Cu68  1  0.233034  0.232468  0.427012  1
  Cu  Cu69  1  0.565962  0.899390  0.427027  1
  Cu  Cu70  1  0.938778  0.938640  0.411923  1
  Cu  Cu71  1  0.860015  0.193448  0.442230  1
  Cu  Cu72  1  0.193485  0.860248  0.442281  1
  Cu  Cu73  1  0.301265  0.634709  0.465132  1
  Cu  Cu74  1  0.634586  0.301335  0.465111  1
  Cu  Cu75  1  0.556150  0.556169  0.495529  1
  Cu  Cu76  1  0.928471  0.595575  0.480332  1
  Cu  Cu77  1  0.262125  0.261921  0.480332  1
  Cu  Cu78  1  0.595278  0.928728  0.480335  1
  Cu  Cu79  1  0.967892  0.968029  0.465111  1
  Cu  Cu80  1  0.889382  0.222840  0.495540  1
  Cu  Cu81  1  0.222712  0.889607  0.495529  1
  Cu  Cu82  1  0.036403  0.369863  0.503097  1
  Cu  Cu83  1  0.487668  0.154097  0.457462  1
  Cu  Cu84  1  0.409041  0.409114  0.487958  1
  Cu  Cu85  1  0.781717  0.448349  0.472677  1
  Cu  Cu86  1  0.114902  0.115165  0.472677  1
  Cu  Cu87  1  0.448293  0.781740  0.472695  1
  Cu  Cu88  1  0.820657  0.821108  0.457462  1
  Cu  Cu89  1  0.742335  0.075788  0.487917  1
  Cu  Cu90  1  0.075660  0.742495  0.487957  1
  Cu  Cu91  1  0.183411  0.516876  0.510776  1
  Cu  Cu92  1  0.516849  0.183536  0.510765  1
  Cu  Cu93  1  0.438321  0.438425  0.541169  1
  Cu  Cu94  1  0.811022  0.477538  0.525994  1
  Cu  Cu95  1  0.144068  0.144493  0.525994  1
  Cu  Cu96  1  0.477520  0.810992  0.526020  1
  Cu  Cu97  1  0.850072  0.850313  0.510765  1
  Cu  Cu98  1  0.771641  0.105119  0.541168  1
  Cu  Cu99  1  0.104947  0.771799  0.541169  1
  Cu  Cu100  1  0.918666  0.252149  0.548927  1
  Cu  Cu101  1  0.369771  0.036534  0.503190  1
  Cu  Cu102  1  0.291291  0.291283  0.533607  1
  Cu  Cu103  1  0.663874  0.330653  0.518358  1
  Cu  Cu104  1  0.997185  0.997342  0.518358  1
  Cu  Cu105  1  0.330518  0.663986  0.518328  1
  Cu  Cu106  1  0.703073  0.703232  0.503190  1
  Cu  Cu107  1  0.624521  0.957996  0.533614  1
  Cu  Cu108  1  0.957809  0.624766  0.533607  1
  Cu  Cu109  1  0.065686  0.399170  0.556411  1
  Cu  Cu110  1  0.399052  0.065859  0.556510  1
  Cu  Cu111  1  0.320491  0.320528  0.586857  1
  Cu  Cu112  1  0.693194  0.360069  0.571680  1
  Cu  Cu113  1  0.026577  0.026686  0.571679  1
  Cu  Cu114  1  0.359794  0.693284  0.571486  1
  Cu  Cu115  1  0.732375  0.732536  0.556510  1
  Cu  Cu116  1  0.653685  0.987184  0.586854  1
  Cu  Cu117  1  0.987029  0.653990  0.586856  1
  Cu  Cu118  1  0.800876  0.134378  0.594297  1
  Cu  Cu119  1  0.251863  0.919056  0.548801  1
  Cu  Cu120  1  0.173214  0.173892  0.579308  1
  Cu  Cu121  1  0.546169  0.212961  0.564033  1
  Cu  Cu122  1  0.879472  0.879658  0.564033  1
  Cu  Cu123  1  0.212674  0.546162  0.563973  1
  Cu  Cu124  1  0.585575  0.585344  0.548801  1
  Cu  Cu125  1  0.506714  0.840210  0.579364  1
  Cu  Cu126  1  0.840398  0.506708  0.579308  1
  Cu  Cu127  1  0.947783  0.281289  0.602422  1
  Cu  Cu128  1  0.280702  0.948747  0.602114  1
  Cu  Cu129  1  0.202733  0.203534  0.632630  1
  Cu  Cu130  1  0.575598  0.242457  0.617246  1
  Cu  Cu131  1  0.908944  0.909112  0.617246  1
  Cu  Cu132  1  0.241903  0.575417  0.617214  1
  Cu  Cu133  1  0.615242  0.614206  0.602113  1
  Cu  Cu134  1  0.536178  0.869696  0.632751  1
  Cu  Cu135  1  0.870017  0.536249  0.632630  1
  Cu  Cu136  1  0.682873  0.016396  0.639956  1
  Cu  Cu137  1  0.134328  0.800930  0.594342  1
  Cu  Cu138  1  0.056311  0.056230  0.625287  1
  Cu  Cu139  1  0.428376  0.094943  0.609857  1
  Cu  Cu140  1  0.761434  0.761885  0.609857  1
  Cu  Cu141  1  0.094948  0.428457  0.609719  1
  Cu  Cu142  1  0.467427  0.467831  0.594343  1
  Cu  Cu143  1  0.389204  0.722717  0.624450  1
  Cu  Cu144  1  0.722713  0.389827  0.625288  1
  Cu  Cu145  1  0.829929  0.163450  0.647353  1
  Cu  Cu146  1  0.163389  0.830158  0.647432  1
  Cu  Cu147  1  0.085320  0.084767  0.679943  1
  Cu  Cu148  1  0.457533  0.123795  0.663210  1
  Cu  Cu149  1  0.790257  0.791070  0.663210  1
  Cu  Cu150  1  0.123597  0.457134  0.662952  1
  Cu  Cu151  1  0.496634  0.496913  0.647435  1
  Cu  Cu152  1  0.418086  0.751633  0.676949  1
  Cu  Cu153  1  0.751214  0.418872  0.679943  1
  Cu  Cu154  1  0.564786  0.898347  0.687298  1
  Cu  Cu155  1  0.016378  0.683247  0.640014  1
  Cu  Cu156  1  0.937370  0.937800  0.669995  1
  Cu  Cu157  1  0.308802  0.978683  0.655417  1
  Cu  Cu158  1  0.645155  0.642328  0.655414  1
  Cu  Cu159  1  0.976389  0.309920  0.655730  1
  Cu  Cu160  1  0.349724  0.349901  0.640014  1
  Cu  Cu161  1  0.271227  0.604771  0.670582  1
  Cu  Cu162  1  0.604258  0.270910  0.669994  1
  Cu  Cu163  1  0.712103  0.045669  0.693606  1
  Cu  Cu164  1  0.045945  0.712808  0.693670  1
  Cu  Cu165  1  0.956142  0.955617  0.719610  1
  Cu  Cu166  1  0.335751  1.000326  0.706816  1
  Cu  Cu167  1  0.666752  0.669327  0.706813  1
  Cu  Cu168  1  0.001391  0.334965  0.706127  1
  Cu  Cu169  1  0.379244  0.379511  0.693670  1
  Cu  Cu170  1  0.287788  0.621375  0.721169  1
  Cu  Cu171  1  0.622025  0.289733  0.719609  1
  Cu  Cu172  1  0.432072  0.765671  0.726555  1
  Cu  Cu173  1  0.899807  0.566972  0.686277  1
  Cu  Cu174  1  0.812975  0.812191  0.713635  1
  Cu  Cu175  1  0.193601  0.853751  0.700437  1
  Cu  Cu176  1  0.520185  0.527173  0.700439  1
  Cu  Cu177  1  0.855788  0.189355  0.699640  1
  Cu  Cu178  1  0.233414  0.233365  0.686277  1
  Cu  Cu179  1  0.144220  0.477803  0.713381  1
  Cu  Cu180  1  0.478606  0.146554  0.713634  1
