# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.55460258
_cell_length_b   4.20034502
_cell_length_c   46.72694585
_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   501.390046458
_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  0.002799  0.751290  0.317198  1
  Cu  Cu2  1  0.502799  0.251290  0.302893  1
  Cu  Cu3  1  0.502799  0.751290  0.364310  1
  Cu  Cu4  1  0.002799  0.251290  0.348815  1
  Cu  Cu5  1  0.002799  0.751290  0.412312  1
  Cu  Cu6  1  0.502799  0.251290  0.396259  1
  Cu  Cu7  1  0.502799  0.751290  0.460204  1
  Cu  Cu8  1  0.002799  0.251290  0.443976  1
  Cu  Cu9  1  0.002799  0.751290  0.508053  1
  Cu  Cu10  1  0.502799  0.251290  0.491785  1
  Cu  Cu11  1  0.502799  0.751290  0.555863  1
  Cu  Cu12  1  0.002799  0.251290  0.539634  1
  Cu  Cu13  1  0.002799  0.751290  0.603580  1
  Cu  Cu14  1  0.502799  0.251290  0.587527  1
  Cu  Cu15  1  0.502799  0.751290  0.651024  1
  Cu  Cu16  1  0.002799  0.251290  0.635528  1
  Cu  Cu17  1  0.002799  0.751290  0.696945  1
  Cu  Cu18  1  0.502799  0.251290  0.682640  1
