# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.55204505
_cell_length_b   4.09472738
_cell_length_c   48.90583420
_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   511.062481861
_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  1.001207  0.253572  0.301318  1
  Cu  Cu2  1  0.501207  0.753572  0.286331  1
  Cu  Cu3  1  0.501207  0.253572  0.346688  1
  Cu  Cu4  1  1.001207  0.753572  0.331729  1
  Cu  Cu5  1  1.001207  0.253572  0.392210  1
  Cu  Cu6  1  0.501207  0.753572  0.376989  1
  Cu  Cu7  1  0.501207  0.253572  0.437718  1
  Cu  Cu8  1  1.001207  0.753572  0.422441  1
  Cu  Cu9  1  1.001207  0.253572  0.483212  1
  Cu  Cu10  1  0.501207  0.753572  0.467918  1
  Cu  Cu11  1  0.501207  0.253572  0.528698  1
  Cu  Cu12  1  1.001207  0.753572  0.513405  1
  Cu  Cu13  1  1.001207  0.253572  0.574176  1
  Cu  Cu14  1  0.501207  0.753572  0.558898  1
  Cu  Cu15  1  0.501207  0.253572  0.619627  1
  Cu  Cu16  1  1.001207  0.753572  0.604406  1
  Cu  Cu17  1  1.001207  0.253572  0.664887  1
  Cu  Cu18  1  0.501207  0.753572  0.649928  1
  Cu  Cu19  1  0.501207  0.253572  0.710285  1
  Cu  Cu20  1  1.001207  0.753572  0.695298  1
