# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.09830661
_cell_length_b   8.82001066
_cell_length_c   47.89334353
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   102.92096638
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu
_chemical_formula_sum   Cu66
_cell_volume   1687.37074848
_cell_formula_units_Z   66
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  0.630197  0.879038  0.276384  1
  Cu  Cu2  1  0.768516  0.184545  0.289802  1
  Cu  Cu3  1  0.899419  0.493343  0.303455  1
  Cu  Cu4  1  0.051981  0.718775  0.271528  1
  Cu  Cu5  1  0.199230  0.028778  0.283366  1
  Cu  Cu6  1  0.335776  0.340517  0.295918  1
  Cu  Cu7  1  0.022646  0.813913  0.318320  1
  Cu  Cu8  1  0.147916  0.126195  0.331158  1
  Cu  Cu9  1  0.274504  0.437543  0.344270  1
  Cu  Cu10  1  0.466921  0.653169  0.308280  1
  Cu  Cu11  1  0.585626  0.970117  0.324390  1
  Cu  Cu12  1  0.709927  0.280457  0.338075  1
  Cu  Cu13  1  0.399503  0.748200  0.357969  1
  Cu  Cu14  1  0.520032  0.063544  0.372929  1
  Cu  Cu15  1  0.643585  0.375970  0.386665  1
  Cu  Cu16  1  0.835263  0.592124  0.351575  1
  Cu  Cu17  1  0.958372  0.907199  0.366266  1
  Cu  Cu18  1  0.082065  0.220296  0.379734  1
  Cu  Cu19  1  0.768016  0.687443  0.400447  1
  Cu  Cu20  1  0.891727  1.001362  0.414702  1
  Cu  Cu21  1  0.015029  0.314314  0.428442  1
  Cu  Cu22  1  0.206294  0.531900  0.393289  1
  Cu  Cu23  1  0.330899  0.843760  0.407230  1
  Cu  Cu24  1  0.453324  0.157879  0.421548  1
  Cu  Cu25  1  0.138970  0.626450  0.442232  1
  Cu  Cu26  1  0.263124  0.938889  0.456170  1
  Cu  Cu27  1  0.386158  0.252111  0.470250  1
  Cu  Cu28  1  0.576634  0.470358  0.435423  1
  Cu  Cu29  1  0.700837  0.782523  0.449291  1
  Cu  Cu30  1  0.824500  0.095682  0.463332  1
  Cu  Cu31  1  0.509481  0.564921  0.484214  1
  Cu  Cu32  1  0.633498  0.877350  0.498128  1
  Cu  Cu33  1  0.757274  0.190011  0.512044  1
  Cu  Cu34  1  0.947872  0.408521  0.477177  1
  Cu  Cu35  1  0.071648  0.721182  0.491094  1
  Cu  Cu36  1  0.195665  0.033612  0.505008  1
  Cu  Cu37  1  0.880645  0.502850  0.525889  1
  Cu  Cu38  1  0.004309  0.816010  0.539930  1
  Cu  Cu39  1  0.128512  0.128175  0.553798  1
  Cu  Cu40  1  0.318988  0.346421  0.518971  1
  Cu  Cu41  1  0.442022  0.659643  0.533051  1
  Cu  Cu42  1  0.566176  0.972082  0.546989  1
  Cu  Cu43  1  0.251822  0.440653  0.567673  1
  Cu  Cu44  1  0.374247  0.754773  0.581991  1
  Cu  Cu45  1  0.498852  0.066632  0.595933  1
  Cu  Cu46  1  0.690117  0.284218  0.560779  1
  Cu  Cu47  1  0.813419  0.597171  0.574519  1
  Cu  Cu48  1  0.937130  0.911090  0.588774  1
  Cu  Cu49  1  0.623080  0.378237  0.609487  1
  Cu  Cu50  1  0.746773  0.691334  0.622956  1
  Cu  Cu51  1  0.869883  1.006408  0.637647  1
  Cu  Cu52  1  0.061561  0.222562  0.602557  1
  Cu  Cu53  1  0.185114  0.534988  0.616293  1
  Cu  Cu54  1  0.305643  0.850332  0.631252  1
  Cu  Cu55  1  0.995219  0.318075  0.651146  1
  Cu  Cu56  1  0.119520  0.628415  0.664832  1
  Cu  Cu57  1  0.238225  0.945363  0.680942  1
  Cu  Cu58  1  0.430642  0.160989  0.644952  1
  Cu  Cu59  1  0.557230  0.472337  0.658064  1
  Cu  Cu60  1  0.682500  0.784620  0.670902  1
  Cu  Cu61  1  0.369370  0.258015  0.693303  1
  Cu  Cu62  1  0.505916  0.569754  0.705855  1
  Cu  Cu63  1  0.653165  0.879757  0.717694  1
  Cu  Cu64  1  0.805727  0.105189  0.685767  1
  Cu  Cu65  1  0.936630  0.413988  0.699419  1
  Cu  Cu66  1  0.074949  0.719495  0.712837  1
