# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.93106108
_cell_length_b   6.62450412
_cell_length_c   47.80227836
_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   Cu32
_cell_volume   928.168530022
_cell_formula_units_Z   32
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  0.505058  0.079030  0.325096  1
  Cu  Cu2  1  0.505058  0.685276  0.297361  1
  Cu  Cu3  1  1.005058  0.377704  0.310580  1
  Cu  Cu4  1  1.005058  0.983151  0.285329  1
  Cu  Cu5  1  0.505058  0.876842  0.380270  1
  Cu  Cu6  1  0.505058  0.476511  0.351763  1
  Cu  Cu7  1  1.005058  0.178163  0.366551  1
  Cu  Cu8  1  1.005058  0.777102  0.338171  1
  Cu  Cu9  1  0.505058  0.675729  0.435811  1
  Cu  Cu10  1  0.505058  0.277005  0.408163  1
  Cu  Cu11  1  1.005058  0.976129  0.421980  1
  Cu  Cu12  1  0.005058  0.576514  0.393945  1
  Cu  Cu13  1  0.505058  0.474931  0.491633  1
  Cu  Cu14  1  0.505058  0.075319  0.463762  1
  Cu  Cu15  1  0.005058  0.775059  0.477663  1
  Cu  Cu16  1  0.005058  0.375859  0.449885  1
  Cu  Cu17  1  0.505058  0.273513  0.547275  1
  Cu  Cu18  1  0.505058  0.874313  0.519496  1
  Cu  Cu19  1  0.005058  0.574054  0.533397  1
  Cu  Cu20  1  0.005058  0.174442  0.505526  1
  Cu  Cu21  1  0.505058  0.072858  0.603215  1
  Cu  Cu22  1  0.505058  0.673243  0.575180  1
  Cu  Cu23  1  1.005058  0.372367  0.588996  1
  Cu  Cu24  1  1.005058  0.973643  0.561349  1
  Cu  Cu25  1  0.505058  0.872270  0.658988  1
  Cu  Cu26  1  0.505058  0.471209  0.630608  1
  Cu  Cu27  1  1.005058  0.172862  0.645396  1
  Cu  Cu28  1  0.005058  0.772531  0.616889  1
  Cu  Cu29  1  0.505058  0.666222  0.711831  1
  Cu  Cu30  1  0.505058  0.271668  0.686580  1
  Cu  Cu31  1  1.005058  0.964096  0.699798  1
  Cu  Cu32  1  0.005058  0.570343  0.672063  1
