# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.54121834
_cell_length_b   4.24222571
_cell_length_c   48.46064065
_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   522.426145726
_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  1.000869  0.750317  0.303242  1
  Cu  Cu2  1  0.500869  0.250317  0.289259  1
  Cu  Cu3  1  0.500869  0.750317  0.348483  1
  Cu  Cu4  1  1.000869  0.250317  0.333532  1
  Cu  Cu5  1  1.000869  0.750317  0.394129  1
  Cu  Cu6  1  0.500869  0.250317  0.379029  1
  Cu  Cu7  1  0.500869  0.750317  0.439701  1
  Cu  Cu8  1  1.000869  0.250317  0.424510  1
  Cu  Cu9  1  1.000869  0.750317  0.485255  1
  Cu  Cu10  1  0.500869  0.250317  0.470033  1
  Cu  Cu11  1  0.500869  0.750317  0.530796  1
  Cu  Cu12  1  1.000869  0.250317  0.515574  1
  Cu  Cu13  1  1.000869  0.750317  0.576320  1
  Cu  Cu14  1  0.500869  0.250317  0.561129  1
  Cu  Cu15  1  0.500869  0.750317  0.621801  1
  Cu  Cu16  1  1.000869  0.250317  0.606701  1
  Cu  Cu17  1  1.000869  0.750317  0.667298  1
  Cu  Cu18  1  0.500869  0.250317  0.652346  1
  Cu  Cu19  1  0.500869  0.750317  0.711571  1
  Cu  Cu20  1  1.000869  0.250317  0.697588  1
