# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.09158228
_cell_length_b   4.93019397
_cell_length_c   45.83368486
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   69.20061649
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu
_chemical_formula_sum   Cu72
_cell_volume   1920.52808124
_cell_formula_units_Z   72
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  0.810030  0.492663  0.293996  1
  Cu  Cu2  1  0.090255  0.442676  0.305133  1
  Cu  Cu3  1  0.527475  0.548386  0.283133  1
  Cu  Cu4  1  0.879621  0.955702  0.302832  1
  Cu  Cu5  1  0.322648  0.057097  0.281737  1
  Cu  Cu6  1  0.601529  0.004332  0.291753  1
  Cu  Cu7  1  0.650485  0.337879  0.331079  1
  Cu  Cu8  1  0.929929  0.285819  0.342664  1
  Cu  Cu9  1  0.368779  0.395072  0.318496  1
  Cu  Cu10  1  0.718391  0.796658  0.340392  1
  Cu  Cu11  1  0.158642  0.896673  0.315090  1
  Cu  Cu12  1  0.439966  0.849251  0.329336  1
  Cu  Cu13  1  0.486693  0.187078  0.367603  1
  Cu  Cu14  1  0.767111  0.132030  0.379956  1
  Cu  Cu15  1  0.206916  0.236131  0.354712  1
  Cu  Cu16  1  0.555072  0.643104  0.377877  1
  Cu  Cu17  1  0.995746  0.745538  0.352383  1
  Cu  Cu18  1  0.273869  0.696229  0.365164  1
  Cu  Cu19  1  0.324408  0.031600  0.404512  1
  Cu  Cu20  1  0.603946  0.979657  0.417047  1
  Cu  Cu21  1  0.045551  0.081532  0.392186  1
  Cu  Cu22  1  0.391587  0.489732  0.414702  1
  Cu  Cu23  1  0.834055  0.590899  0.389799  1
  Cu  Cu24  1  0.112561  0.540066  0.402103  1
  Cu  Cu25  1  0.162218  0.876491  0.441748  1
  Cu  Cu26  1  0.441259  0.825593  0.454130  1
  Cu  Cu27  1  0.883309  0.927182  0.429426  1
  Cu  Cu28  1  0.229201  0.335053  0.451779  1
  Cu  Cu29  1  0.671374  0.437289  0.427134  1
  Cu  Cu30  1  0.950313  0.385972  0.439407  1
  Cu  Cu31  1  0.999734  0.722289  0.478948  1
  Cu  Cu32  1  0.278825  0.671121  0.491324  1
  Cu  Cu33  1  0.720482  0.773877  0.466560  1
  Cu  Cu34  1  0.066810  0.180694  0.488975  1
  Cu  Cu35  1  0.508379  0.283814  0.464212  1
  Cu  Cu36  1  0.787699  0.232058  0.476608  1
  Cu  Cu37  1  0.836971  0.568594  0.516075  1
  Cu  Cu38  1  0.116291  0.516838  0.528472  1
  Cu  Cu39  1  0.557860  0.619958  0.503708  1
  Cu  Cu40  1  0.904188  0.026775  0.526123  1
  Cu  Cu41  1  0.345846  0.129532  0.501360  1
  Cu  Cu42  1  0.624937  0.078363  0.513736  1
  Cu  Cu43  1  0.674357  0.414680  0.553277  1
  Cu  Cu44  1  0.953297  0.363363  0.565550  1
  Cu  Cu45  1  0.395469  0.465599  0.540905  1
  Cu  Cu46  1  0.741362  0.873471  0.563258  1
  Cu  Cu47  1  0.183412  0.975059  0.538553  1
  Cu  Cu48  1  0.462453  0.924161  0.550936  1
  Cu  Cu49  1  0.512109  0.260587  0.590580  1
  Cu  Cu50  1  0.790615  0.209753  0.602884  1
  Cu  Cu51  1  0.233083  0.310920  0.577982  1
  Cu  Cu52  1  0.579119  0.719121  0.600497  1
  Cu  Cu53  1  0.020725  0.820996  0.575637  1
  Cu  Cu54  1  0.300262  0.769052  0.588172  1
  Cu  Cu55  1  0.350801  0.104423  0.627519  1
  Cu  Cu56  1  0.628924  0.055114  0.640300  1
  Cu  Cu57  1  0.069598  0.157548  0.614807  1
  Cu  Cu58  1  0.417754  0.564521  0.637971  1
  Cu  Cu59  1  0.857559  0.668622  0.612728  1
  Cu  Cu60  1  0.137978  0.613574  0.625081  1
  Cu  Cu61  1  0.184704  0.951402  0.663347  1
  Cu  Cu62  1  0.466028  0.903980  0.677594  1
  Cu  Cu63  1  0.906279  1.003994  0.652291  1
  Cu  Cu64  1  0.255892  0.405580  0.674187  1
  Cu  Cu65  1  0.694741  0.514833  0.650019  1
  Cu  Cu66  1  0.974186  0.462774  0.661604  1
  Cu  Cu67  1  0.023141  0.796320  0.700930  1
  Cu  Cu68  1  0.302022  0.743555  0.710947  1
  Cu  Cu69  1  0.745049  0.844950  0.689852  1
  Cu  Cu70  1  0.097196  0.252266  0.709551  1
  Cu  Cu71  1  0.534415  0.357976  0.687550  1
  Cu  Cu72  1  0.814640  0.307990  0.698687  1
