# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.56298963
_cell_length_b   5.11444122
_cell_length_c   46.19166188
_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   841.73684375
_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  0.507288  0.499788  0.278433  1
  Cu  Cu2  1  1.007288  0.751918  0.303398  1
  Cu  Cu3  1  1.007288  0.247659  0.303398  1
  Cu  Cu4  1  0.507288  0.499788  0.331678  1
  Cu  Cu5  1  0.507288  0.999788  0.330177  1
  Cu  Cu6  1  1.007288  0.248941  0.358574  1
  Cu  Cu7  1  1.007288  0.750636  0.358574  1
  Cu  Cu8  1  0.507288  0.999788  0.386233  1
  Cu  Cu9  1  0.507288  0.499788  0.386695  1
  Cu  Cu10  1  1.007288  0.750091  0.414356  1
  Cu  Cu11  1  1.007288  0.249486  0.414356  1
  Cu  Cu12  1  0.507288  0.499788  0.442318  1
  Cu  Cu13  1  0.507288  0.999788  0.442187  1
  Cu  Cu14  1  1.007288  0.249730  0.470145  1
  Cu  Cu15  1  1.007288  0.749847  0.470145  1
  Cu  Cu16  1  0.507288  0.999788  0.498006  1
  Cu  Cu17  1  0.507288  0.499788  0.498072  1
  Cu  Cu18  1  1.007288  0.749730  0.525932  1
  Cu  Cu19  1  1.007288  0.249847  0.525932  1
  Cu  Cu20  1  0.507288  0.499788  0.553890  1
  Cu  Cu21  1  0.507288  0.999788  0.553759  1
  Cu  Cu22  1  1.007288  0.250091  0.581722  1
  Cu  Cu23  1  1.007288  0.749486  0.581722  1
  Cu  Cu24  1  0.507288  0.999788  0.609382  1
  Cu  Cu25  1  0.507288  0.499788  0.609845  1
  Cu  Cu26  1  1.007288  0.748941  0.637504  1
  Cu  Cu27  1  1.007288  0.250636  0.637504  1
  Cu  Cu28  1  0.507288  0.499788  0.665900  1
  Cu  Cu29  1  0.507288  0.999788  0.664400  1
  Cu  Cu30  1  1.007288  0.251918  0.692680  1
  Cu  Cu31  1  1.007288  0.747659  0.692680  1
  Cu  Cu32  1  0.507288  0.999788  0.717645  1
