# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.54177131
_cell_length_b   2.54177131
_cell_length_c   61.84687644
_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   Cu16
_cell_volume   399.568015383
_cell_formula_units_Z   16
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  0.556299  0.556299  0.197522  1
  Cu  Cu2  1  1.056299  1.056299  0.168012  1
  Cu  Cu3  1  0.556299  0.556299  0.256213  1
  Cu  Cu4  1  1.056299  1.056299  0.226779  1
  Cu  Cu5  1  0.556299  0.556299  0.315082  1
  Cu  Cu6  1  1.056299  1.056299  0.285649  1
  Cu  Cu7  1  0.556299  0.556299  0.373949  1
  Cu  Cu8  1  1.056299  1.056299  0.344515  1
  Cu  Cu9  1  0.556299  0.556299  0.432816  1
  Cu  Cu10  1  1.056299  1.056299  0.403382  1
  Cu  Cu11  1  0.556299  0.556299  0.491682  1
  Cu  Cu12  1  1.056299  1.056299  0.462249  1
  Cu  Cu13  1  0.556299  0.556299  0.550552  1
  Cu  Cu14  1  1.056299  1.056299  0.521118  1
  Cu  Cu15  1  0.556299  0.556299  0.609319  1
  Cu  Cu16  1  1.056299  1.056299  0.579809  1
