# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.18725637
_cell_length_b   4.90412327
_cell_length_c   45.90345324
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   68.83560353
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu
_chemical_formula_sum   Cu72
_cell_volume   1928.696633
_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  0.822006  0.449530  0.296655  1
  Cu  Cu2  1  0.099155  0.396238  0.307806  1
  Cu  Cu3  1  0.545613  0.500937  0.285063  1
  Cu  Cu4  1  0.885869  0.909421  0.305676  1
  Cu  Cu5  1  0.331736  0.004959  0.283797  1
  Cu  Cu6  1  0.609099  0.958368  0.294396  1
  Cu  Cu7  1  0.659975  0.288644  0.332712  1
  Cu  Cu8  1  0.939840  0.234286  0.344705  1
  Cu  Cu9  1  0.377723  0.350120  0.319550  1
  Cu  Cu10  1  0.727357  0.744009  0.342379  1
  Cu  Cu11  1  0.165015  0.853635  0.317400  1
  Cu  Cu12  1  0.447676  0.799880  0.330705  1
  Cu  Cu13  1  0.497667  0.129869  0.369194  1
  Cu  Cu14  1  0.778114  0.073271  0.381757  1
  Cu  Cu15  1  0.218439  0.181892  0.356335  1
  Cu  Cu16  1  0.565376  0.584775  0.379633  1
  Cu  Cu17  1  0.005926  0.691416  0.354216  1
  Cu  Cu18  1  0.284686  0.638763  0.366822  1
  Cu  Cu19  1  0.336308  0.967188  0.406292  1
  Cu  Cu20  1  0.616107  0.913240  0.418923  1
  Cu  Cu21  1  0.057366  0.019615  0.393999  1
  Cu  Cu22  1  0.403867  0.423444  0.416510  1
  Cu  Cu23  1  0.845203  0.530303  0.391775  1
  Cu  Cu24  1  0.124487  0.476491  0.403893  1
  Cu  Cu25  1  0.175392  0.804580  0.443632  1
  Cu  Cu26  1  0.454842  0.751204  0.456042  1
  Cu  Cu27  1  0.896031  0.858369  0.431329  1
  Cu  Cu28  1  0.242944  0.261335  0.453620  1
  Cu  Cu29  1  0.683892  0.369016  0.428972  1
  Cu  Cu30  1  0.963601  0.314987  0.441261  1
  Cu  Cu31  1  0.014251  0.642852  0.480895  1
  Cu  Cu32  1  0.293764  0.589113  0.493280  1
  Cu  Cu33  1  0.734582  0.697017  0.468500  1
  Cu  Cu34  1  0.081837  0.099460  0.490865  1
  Cu  Cu35  1  0.522480  0.207695  0.466104  1
  Cu  Cu36  1  0.802202  0.153527  0.478491  1
  Cu  Cu37  1  0.852887  0.481381  0.518078  1
  Cu  Cu38  1  0.132609  0.427213  0.530465  1
  Cu  Cu39  1  0.573252  0.535449  0.505704  1
  Cu  Cu40  1  0.920506  0.937892  0.528069  1
  Cu  Cu41  1  0.361325  0.045795  0.503288  1
  Cu  Cu42  1  0.640838  0.992056  0.515674  1
  Cu  Cu43  1  0.691488  0.319922  0.555308  1
  Cu  Cu44  1  0.971197  0.265893  0.567597  1
  Cu  Cu45  1  0.412145  0.373574  0.542949  1
  Cu  Cu46  1  0.759058  0.776539  0.565240  1
  Cu  Cu47  1  0.200247  0.883704  0.540527  1
  Cu  Cu48  1  0.479697  0.830328  0.552937  1
  Cu  Cu49  1  0.530601  0.158418  0.592676  1
  Cu  Cu50  1  0.809886  0.104605  0.604794  1
  Cu  Cu51  1  0.251222  0.211464  0.580059  1
  Cu  Cu52  1  0.597723  0.615293  0.602570  1
  Cu  Cu53  1  0.038981  0.721669  0.577646  1
  Cu  Cu54  1  0.318781  0.667720  0.590277  1
  Cu  Cu55  1  0.370402  0.996145  0.629747  1
  Cu  Cu56  1  0.649163  0.943492  0.642353  1
  Cu  Cu57  1  0.089713  0.050133  0.616936  1
  Cu  Cu58  1  0.436650  0.453016  0.640234  1
  Cu  Cu59  1  0.876974  0.561637  0.614812  1
  Cu  Cu60  1  0.157422  0.505039  0.627375  1
  Cu  Cu61  1  0.207413  0.835028  0.665864  1
  Cu  Cu62  1  0.490074  0.781274  0.679169  1
  Cu  Cu63  1  0.927732  0.890899  0.654190  1
  Cu  Cu64  1  0.277366  0.284789  0.677019  1
  Cu  Cu65  1  0.715249  0.400622  0.651864  1
  Cu  Cu66  1  0.995114  0.346264  0.663857  1
  Cu  Cu67  1  0.045989  0.676540  0.702173  1
  Cu  Cu68  1  0.323353  0.629949  0.712772  1
  Cu  Cu69  1  0.769220  0.725487  0.690893  1
  Cu  Cu70  1  0.109476  0.133971  0.711506  1
  Cu  Cu71  1  0.555934  0.238670  0.688763  1
  Cu  Cu72  1  0.833083  0.185378  0.699914  1
