# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.38513107
_cell_length_b   6.37396609
_cell_length_c   46.88434519
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   78.46304097
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu
_chemical_formula_sum   Cu72
_cell_volume   1869.57562232
_cell_formula_units_Z   72
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  0.664799  0.666299  0.290628  1
  Cu  Cu2  1  0.040780  0.042345  0.338219  1
  Cu  Cu3  1  0.040845  0.537987  0.307463  1
  Cu  Cu4  1  0.536801  0.042263  0.307482  1
  Cu  Cu5  1  0.412498  0.414109  0.291133  1
  Cu  Cu6  1  0.917101  0.918489  0.291133  1
  Cu  Cu7  1  0.792798  0.290335  0.307482  1
  Cu  Cu8  1  0.288754  0.794611  0.307463  1
  Cu  Cu9  1  0.539616  0.541217  0.338071  1
  Cu  Cu10  1  0.914861  0.916337  0.386631  1
  Cu  Cu11  1  0.913847  0.417251  0.355964  1
  Cu  Cu12  1  0.415752  0.915347  0.355964  1
  Cu  Cu13  1  0.288819  0.290253  0.338219  1
  Cu  Cu14  1  0.789983  0.791381  0.338071  1
  Cu  Cu15  1  0.664799  0.166299  0.355597  1
  Cu  Cu16  1  0.164800  0.666299  0.355581  1
  Cu  Cu17  1  0.414737  0.416261  0.386631  1
  Cu  Cu18  1  0.789858  0.791355  0.435544  1
  Cu  Cu19  1  0.789674  0.291136  0.404623  1
  Cu  Cu20  1  0.289639  0.791168  0.404620  1
  Cu  Cu21  1  0.164800  0.166299  0.386839  1
  Cu  Cu22  1  0.664799  0.666299  0.386857  1
  Cu  Cu23  1  0.539924  0.041464  0.404623  1
  Cu  Cu24  1  0.039961  0.541428  0.404620  1
  Cu  Cu25  1  0.289843  0.291348  0.435547  1
  Cu  Cu26  1  0.664792  0.666291  0.484367  1
  Cu  Cu27  1  0.664793  0.166306  0.453483  1
  Cu  Cu28  1  0.164806  0.666292  0.453482  1
  Cu  Cu29  1  0.039758  0.041252  0.435546  1
  Cu  Cu30  1  0.539739  0.541241  0.435545  1
  Cu  Cu31  1  0.414805  0.916293  0.453458  1
  Cu  Cu32  1  0.914794  0.416305  0.453458  1
  Cu  Cu33  1  0.164807  0.166306  0.484368  1
  Cu  Cu34  1  0.539702  0.541201  0.533211  1
  Cu  Cu35  1  0.539784  0.041342  0.502312  1
  Cu  Cu36  1  0.039842  0.541284  0.502313  1
  Cu  Cu37  1  0.914800  0.916298  0.484365  1
  Cu  Cu38  1  0.414799  0.416300  0.484374  1
  Cu  Cu39  1  0.289815  0.791256  0.502312  1
  Cu  Cu40  1  0.789757  0.291314  0.502313  1
  Cu  Cu41  1  0.039756  0.041253  0.533172  1
  Cu  Cu42  1  0.414799  0.416299  0.582255  1
  Cu  Cu43  1  0.414799  0.916299  0.551118  1
  Cu  Cu44  1  0.914799  0.416299  0.551120  1
  Cu  Cu45  1  0.789843  0.791344  0.533172  1
  Cu  Cu46  1  0.289897  0.291398  0.533211  1
  Cu  Cu47  1  0.165026  0.666074  0.551215  1
  Cu  Cu48  1  0.664573  0.166524  0.551215  1
  Cu  Cu49  1  0.914799  0.916299  0.581949  1
  Cu  Cu50  1  0.289180  0.290628  0.631336  1
  Cu  Cu51  1  0.290983  0.790641  0.600068  1
  Cu  Cu52  1  0.789123  0.292473  0.600069  1
  Cu  Cu53  1  0.664651  0.666155  0.581898  1
  Cu  Cu54  1  0.164948  0.166443  0.581898  1
  Cu  Cu55  1  0.040475  0.540125  0.600069  1
  Cu  Cu56  1  0.538616  0.041957  0.600068  1
  Cu  Cu57  1  0.787973  0.789501  0.630158  1
  Cu  Cu58  1  0.164941  0.166508  0.680547  1
  Cu  Cu59  1  0.169175  0.661952  0.648626  1
  Cu  Cu60  1  0.660424  0.170646  0.648626  1
  Cu  Cu61  1  0.540419  0.541970  0.631336  1
  Cu  Cu62  1  0.041626  0.043097  0.630158  1
  Cu  Cu63  1  0.914799  0.416299  0.649576  1
  Cu  Cu64  1  0.414799  0.916299  0.649592  1
  Cu  Cu65  1  0.664658  0.666090  0.680547  1
  Cu  Cu66  1  0.914799  0.916299  0.724330  1
  Cu  Cu67  1  0.034794  0.549118  0.697874  1
  Cu  Cu68  1  0.547629  0.036314  0.697888  1
  Cu  Cu69  1  0.414799  0.416299  0.680486  1
  Cu  Cu70  1  0.914799  0.916299  0.675078  1
  Cu  Cu71  1  0.794805  0.283480  0.697874  1
  Cu  Cu72  1  0.281970  0.796284  0.697888  1
