# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.55404924
_cell_length_b   4.19667833
_cell_length_c   46.71278174
_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   Cu18
_cell_volume   500.692030301
_cell_formula_units_Z   18
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  1.002803  0.751708  0.317152  1
  Cu  Cu2  1  0.502803  0.251708  0.303135  1
  Cu  Cu3  1  0.502803  0.751708  0.364238  1
  Cu  Cu4  1  1.002803  0.251708  0.348882  1
  Cu  Cu5  1  1.002803  0.751708  0.412311  1
  Cu  Cu6  1  0.502803  0.251708  0.396286  1
  Cu  Cu7  1  0.502803  0.751708  0.460239  1
  Cu  Cu8  1  1.002803  0.251708  0.444000  1
  Cu  Cu9  1  1.002803  0.751708  0.508111  1
  Cu  Cu10  1  0.502803  0.251708  0.491822  1
  Cu  Cu11  1  0.502803  0.751708  0.555933  1
  Cu  Cu12  1  1.002803  0.251708  0.539694  1
  Cu  Cu13  1  1.002803  0.751708  0.603647  1
  Cu  Cu14  1  0.502803  0.251708  0.587622  1
  Cu  Cu15  1  0.502803  0.751708  0.651051  1
  Cu  Cu16  1  1.002803  0.251708  0.635695  1
  Cu  Cu17  1  1.002803  0.751708  0.696798  1
  Cu  Cu18  1  0.502803  0.251708  0.682781  1
