# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.12072137
_cell_length_b   8.89829194
_cell_length_c   48.08542778
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   102.92096638
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu
_chemical_formula_sum   Cu66
_cell_volume   1718.52235684
_cell_formula_units_Z   66
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  0.171010  0.860180  0.280156  1
  Cu  Cu2  1  0.318793  0.160583  0.293457  1
  Cu  Cu3  1  0.468047  0.467418  0.306545  1
  Cu  Cu4  1  0.590883  0.700905  0.274736  1
  Cu  Cu5  1  0.742172  1.005205  0.287375  1
  Cu  Cu6  1  0.892748  0.311687  0.299578  1
  Cu  Cu7  1  0.618682  0.787368  0.320543  1
  Cu  Cu8  1  0.769945  0.104494  0.334010  1
  Cu  Cu9  1  0.925822  0.419769  0.346175  1
  Cu  Cu10  1  0.045808  0.627026  0.309485  1
  Cu  Cu11  1  0.195206  0.948567  0.326891  1
  Cu  Cu12  1  0.346423  0.260641  0.340716  1
  Cu  Cu13  1  0.079508  0.729607  0.359630  1
  Cu  Cu14  1  0.236044  0.047888  0.375472  1
  Cu  Cu15  1  0.391559  0.361719  0.389442  1
  Cu  Cu16  1  0.500527  0.572094  0.354405  1
  Cu  Cu17  1  0.657535  0.888505  0.368629  1
  Cu  Cu18  1  0.814615  0.206777  0.382161  1
  Cu  Cu19  1  0.547023  0.674351  0.403101  1
  Cu  Cu20  1  0.704822  0.990834  0.417063  1
  Cu  Cu21  1  0.861762  0.306361  0.430905  1
  Cu  Cu22  1  0.969765  0.519177  0.395415  1
  Cu  Cu23  1  0.125576  0.831903  0.409421  1
  Cu  Cu24  1  0.283267  0.148464  0.424151  1
  Cu  Cu25  1  0.017549  0.619747  0.444612  1
  Cu  Cu26  1  0.173804  0.933762  0.458609  1
  Cu  Cu27  1  0.330685  0.249042  0.472848  1
  Cu  Cu28  1  0.439430  0.462608  0.438096  1
  Cu  Cu29  1  0.595580  0.776594  0.451825  1
  Cu  Cu30  1  0.752378  0.091648  0.465810  1
  Cu  Cu31  1  0.487326  0.563895  0.486844  1
  Cu  Cu32  1  0.643614  0.877964  0.500742  1
  Cu  Cu33  1  0.800015  0.192287  0.514638  1
  Cu  Cu34  1  0.909080  0.406625  0.479744  1
  Cu  Cu35  1  0.065481  0.720948  0.493640  1
  Cu  Cu36  1  0.221769  0.035017  0.507538  1
  Cu  Cu37  1  0.956717  0.507264  0.528571  1
  Cu  Cu38  1  0.113515  0.822318  0.542557  1
  Cu  Cu39  1  0.269665  0.136304  0.556286  1
  Cu  Cu40  1  0.378411  0.349870  0.521534  1
  Cu  Cu41  1  0.535292  0.665150  0.535772  1
  Cu  Cu42  1  0.691546  0.979166  0.549770  1
  Cu  Cu43  1  0.425829  0.450448  0.570231  1
  Cu  Cu44  1  0.583520  0.767009  0.584961  1
  Cu  Cu45  1  0.739330  0.079735  0.598966  1
  Cu  Cu46  1  0.847333  0.292551  0.563477  1
  Cu  Cu47  1  0.004274  0.608079  0.577319  1
  Cu  Cu48  1  0.162073  0.924561  0.591281  1
  Cu  Cu49  1  0.894481  0.392135  0.612221  1
  Cu  Cu50  1  0.051560  0.710407  0.625753  1
  Cu  Cu51  1  0.208568  0.026819  0.639977  1
  Cu  Cu52  1  0.317536  0.237193  0.604940  1
  Cu  Cu53  1  0.473051  0.551024  0.618910  1
  Cu  Cu54  1  0.629588  0.869305  0.634752  1
  Cu  Cu55  1  0.362672  0.338271  0.653666  1
  Cu  Cu56  1  0.513889  0.650345  0.667491  1
  Cu  Cu57  1  0.663287  0.971887  0.684897  1
  Cu  Cu58  1  0.783274  0.179144  0.648207  1
  Cu  Cu59  1  0.939151  0.494418  0.660372  1
  Cu  Cu60  1  0.090413  0.811544  0.673838  1
  Cu  Cu61  1  0.816348  0.287225  0.694804  1
  Cu  Cu62  1  0.966923  0.593707  0.707007  1
  Cu  Cu63  1  0.118213  0.898007  0.719646  1
  Cu  Cu64  1  0.241049  0.131494  0.687837  1
  Cu  Cu65  1  0.390302  0.438330  0.700925  1
  Cu  Cu66  1  0.538085  0.738732  0.714226  1
