# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.92724679
_cell_length_b   4.20152026
_cell_length_c   46.18668505
_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   Cu20
_cell_volume   568.044805352
_cell_formula_units_Z   20
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  0.505716  0.748281  0.294652  1
  Cu  Cu2  1  1.005716  0.248281  0.294652  1
  Cu  Cu3  1  0.505716  0.248281  0.338966  1
  Cu  Cu4  1  1.005716  0.748281  0.338966  1
  Cu  Cu5  1  0.505716  0.748281  0.384769  1
  Cu  Cu6  1  0.005716  0.248281  0.384769  1
  Cu  Cu7  1  0.505716  0.248281  0.430271  1
  Cu  Cu8  1  1.005716  0.748281  0.430271  1
  Cu  Cu9  1  0.505716  0.748281  0.475832  1
  Cu  Cu10  1  1.005716  0.248281  0.475832  1
  Cu  Cu11  1  0.505716  0.248281  0.521378  1
  Cu  Cu12  1  0.005716  0.748281  0.521378  1
  Cu  Cu13  1  0.505716  0.748281  0.566939  1
  Cu  Cu14  1  0.005716  0.248281  0.566939  1
  Cu  Cu15  1  0.505716  0.248281  0.612441  1
  Cu  Cu16  1  0.005716  0.748281  0.612441  1
  Cu  Cu17  1  0.505716  0.748281  0.658244  1
  Cu  Cu18  1  1.005716  0.248281  0.658244  1
  Cu  Cu19  1  0.505716  0.248281  0.702558  1
  Cu  Cu20  1  0.005716  0.748281  0.702558  1
