# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.56284322
_cell_length_b   5.11177726
_cell_length_c   46.27060665
_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   842.701617534
_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  0.507309  0.125049  0.316410  1
  Cu  Cu2  1  0.007309  0.875049  0.289676  1
  Cu  Cu3  1  1.007309  0.375049  0.289676  1
  Cu  Cu4  1  0.507309  0.625049  0.316410  1
  Cu  Cu5  1  0.507309  0.625049  0.371818  1
  Cu  Cu6  1  0.007309  0.375049  0.344136  1
  Cu  Cu7  1  1.007309  0.875049  0.344136  1
  Cu  Cu8  1  0.507309  0.125049  0.371818  1
  Cu  Cu9  1  0.507309  0.125049  0.427556  1
  Cu  Cu10  1  0.007309  0.875049  0.399720  1
  Cu  Cu11  1  1.007309  0.375049  0.399720  1
  Cu  Cu12  1  0.507309  0.625049  0.427556  1
  Cu  Cu13  1  0.507309  0.625049  0.483262  1
  Cu  Cu14  1  1.007309  0.375049  0.455414  1
  Cu  Cu15  1  1.007309  0.875049  0.455414  1
  Cu  Cu16  1  0.507309  0.125049  0.483262  1
  Cu  Cu17  1  0.507309  0.125049  0.538964  1
  Cu  Cu18  1  0.007309  0.875049  0.511116  1
  Cu  Cu19  1  1.007309  0.375049  0.511116  1
  Cu  Cu20  1  0.507309  0.625049  0.538964  1
  Cu  Cu21  1  0.507309  0.625049  0.594659  1
  Cu  Cu22  1  0.007309  0.375049  0.566823  1
  Cu  Cu23  1  1.007309  0.875049  0.566823  1
  Cu  Cu24  1  0.507309  0.125049  0.594659  1
  Cu  Cu25  1  0.507309  0.125049  0.650242  1
  Cu  Cu26  1  0.007309  0.875049  0.622561  1
  Cu  Cu27  1  0.007309  0.375049  0.622561  1
  Cu  Cu28  1  0.507309  0.625049  0.650242  1
  Cu  Cu29  1  0.507309  0.625049  0.704703  1
  Cu  Cu30  1  1.007309  0.375049  0.677969  1
  Cu  Cu31  1  1.007309  0.875049  0.677969  1
  Cu  Cu32  1  0.507309  0.125049  0.704703  1
