# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.06998442
_cell_length_b   4.41910589
_cell_length_c   46.18871947
_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   Cu32
_cell_volume   830.736088342
_cell_formula_units_Z   32
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  0.756633  0.633599  0.279552  1
  Cu  Cu2  1  0.256633  0.825575  0.303198  1
  Cu  Cu3  1  0.756633  0.153804  0.303378  1
  Cu  Cu4  1  0.256633  0.329008  0.330081  1
  Cu  Cu5  1  0.756633  0.661635  0.332783  1
  Cu  Cu6  1  0.256633  0.831447  0.359072  1
  Cu  Cu7  1  0.756633  0.165074  0.359107  1
  Cu  Cu8  1  0.256633  0.331904  0.386538  1
  Cu  Cu9  1  0.756633  0.666900  0.387344  1
  Cu  Cu10  1  0.256633  0.832749  0.414813  1
  Cu  Cu11  1  0.756633  0.168238  0.414826  1
  Cu  Cu12  1  0.256633  0.332998  0.442584  1
  Cu  Cu13  1  0.756633  0.668665  0.442829  1
  Cu  Cu14  1  0.256633  0.833308  0.470586  1
  Cu  Cu15  1  0.756633  0.169018  0.470592  1
  Cu  Cu16  1  0.256633  0.333478  0.498409  1
  Cu  Cu17  1  0.756633  0.669200  0.498538  1
  Cu  Cu18  1  0.256633  0.833660  0.526354  1
  Cu  Cu19  1  0.756633  0.169371  0.526360  1
  Cu  Cu20  1  0.256633  0.334013  0.554118  1
  Cu  Cu21  1  0.756633  0.669681  0.554363  1
  Cu  Cu22  1  0.256633  0.834440  0.582120  1
  Cu  Cu23  1  0.756633  0.169929  0.582133  1
  Cu  Cu24  1  0.256633  0.335778  0.609602  1
  Cu  Cu25  1  0.756633  0.670775  0.610408  1
  Cu  Cu26  1  0.256633  0.837604  0.637840  1
  Cu  Cu27  1  0.756633  0.171232  0.637874  1
  Cu  Cu28  1  0.256633  0.341043  0.664164  1
  Cu  Cu29  1  0.756633  0.673670  0.666866  1
  Cu  Cu30  1  0.256633  0.848874  0.693568  1
  Cu  Cu31  1  0.756633  0.177103  0.693748  1
  Cu  Cu32  1  0.256633  0.369079  0.717394  1
