# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.23936198
_cell_length_b   9.11738751
_cell_length_c   45.97782701
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu
_chemical_formula_sum   Cu66
_cell_volume   1777.13064468
_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  0.250655  0.046492  0.313643  1
  Cu  Cu2  1  0.250655  0.778025  0.300959  1
  Cu  Cu3  1  0.250655  0.503480  0.288692  1
  Cu  Cu4  1  0.750655  0.079804  0.285590  1
  Cu  Cu5  1  0.750655  0.618138  0.309235  1
  Cu  Cu6  1  0.750655  0.347542  0.296896  1
  Cu  Cu7  1  0.250655  0.851440  0.353755  1
  Cu  Cu8  1  0.250655  0.582330  0.340048  1
  Cu  Cu9  1  0.250655  0.310808  0.326365  1
  Cu  Cu10  1  0.750655  0.886539  0.323310  1
  Cu  Cu11  1  0.750655  0.426781  0.349213  1
  Cu  Cu12  1  0.750655  0.156215  0.337246  1
  Cu  Cu13  1  0.250655  0.658060  0.393730  1
  Cu  Cu14  1  0.250655  0.388936  0.380189  1
  Cu  Cu15  1  0.250655  0.119871  0.367357  1
  Cu  Cu16  1  0.750655  0.695167  0.362770  1
  Cu  Cu17  1  0.750655  0.234584  0.389963  1
  Cu  Cu18  1  0.750655  0.964044  0.376688  1
  Cu  Cu19  1  0.250655  0.465604  0.433834  1
  Cu  Cu20  1  0.250655  0.196575  0.420677  1
  Cu  Cu21  1  0.250655  0.927021  0.407384  1
  Cu  Cu22  1  0.750655  0.503164  0.402946  1
  Cu  Cu23  1  0.750655  0.041519  0.429905  1
  Cu  Cu24  1  0.750655  0.771805  0.416438  1
  Cu  Cu25  1  0.250655  0.273263  0.474078  1
  Cu  Cu26  1  0.250655  0.003914  0.460752  1
  Cu  Cu27  1  0.250655  0.734542  0.447318  1
  Cu  Cu28  1  0.750655  0.310952  0.443238  1
  Cu  Cu29  1  0.750655  0.848940  0.469875  1
  Cu  Cu30  1  0.750655  0.579793  0.456510  1
  Cu  Cu31  1  0.250655  0.080697  0.514136  1
  Cu  Cu32  1  0.250655  0.811411  0.500758  1
  Cu  Cu33  1  0.250655  0.542307  0.487397  1
  Cu  Cu34  1  0.750655  0.118304  0.483261  1
  Cu  Cu35  1  0.750655  0.656694  0.509999  1
  Cu  Cu36  1  0.750655  0.387591  0.496638  1
  Cu  Cu37  1  0.250655  0.888050  0.554158  1
  Cu  Cu38  1  0.250655  0.619208  0.540886  1
  Cu  Cu39  1  0.250655  0.350062  0.527521  1
  Cu  Cu40  1  0.750655  0.925739  0.523318  1
  Cu  Cu41  1  0.750655  0.464459  0.550079  1
  Cu  Cu42  1  0.750655  0.195087  0.536644  1
  Cu  Cu43  1  0.250655  0.695837  0.594451  1
  Cu  Cu44  1  0.250655  0.427197  0.580959  1
  Cu  Cu45  1  0.250655  0.157482  0.567492  1
  Cu  Cu46  1  0.750655  0.733397  0.563562  1
  Cu  Cu47  1  0.750655  0.271980  0.590012  1
  Cu  Cu48  1  0.750655  1.002426  0.576720  1
  Cu  Cu49  1  0.250655  0.503834  0.634626  1
  Cu  Cu50  1  0.250655  0.234957  0.620708  1
  Cu  Cu51  1  0.250655  0.964418  0.607434  1
  Cu  Cu52  1  0.750655  0.540941  0.603666  1
  Cu  Cu53  1  0.750655  0.079130  0.630039  1
  Cu  Cu54  1  0.750655  0.810065  0.617207  1
  Cu  Cu55  1  0.250655  0.312462  0.674087  1
  Cu  Cu56  1  0.250655  0.042786  0.660150  1
  Cu  Cu57  1  0.250655  0.772220  0.648184  1
  Cu  Cu58  1  0.750655  0.347561  0.643641  1
  Cu  Cu59  1  0.750655  0.888193  0.671032  1
  Cu  Cu60  1  0.750655  0.616671  0.657348  1
  Cu  Cu61  1  0.250655  0.119197  0.711806  1
  Cu  Cu62  1  0.250655  0.851459  0.700501  1
  Cu  Cu63  1  0.250655  0.580863  0.688161  1
  Cu  Cu64  1  0.750655  0.152509  0.683753  1
  Cu  Cu65  1  0.750655  0.695521  0.708704  1
  Cu  Cu66  1  0.750655  0.420976  0.696437  1
