# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.55132487
_cell_length_b   16.96950997
_cell_length_c   48.69059322
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   94.33057216
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu
_chemical_formula_sum   Cu80
_cell_volume   2102.02771757
_cell_formula_units_Z   80
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  0.043812  0.143022  0.287009  1
  Cu  Cu2  1  0.289849  0.634402  0.307811  1
  Cu  Cu3  1  0.602633  0.260331  0.306382  1
  Cu  Cu4  1  0.356730  0.768320  0.284816  1
  Cu  Cu5  1  0.920220  0.894777  0.275902  1
  Cu  Cu6  1  0.166905  0.388628  0.297552  1
  Cu  Cu7  1  0.977034  0.008763  0.308957  1
  Cu  Cu8  1  0.730735  0.516200  0.288810  1
  Cu  Cu9  1  0.535204  0.125418  0.330790  1
  Cu  Cu10  1  0.781157  0.617067  0.353054  1
  Cu  Cu11  1  0.093856  0.242729  0.351342  1
  Cu  Cu12  1  0.848172  0.751112  0.329126  1
  Cu  Cu13  1  0.412679  0.879966  0.319790  1
  Cu  Cu14  1  0.658275  0.371417  0.341898  1
  Cu  Cu15  1  0.468464  0.991667  0.354644  1
  Cu  Cu16  1  0.222610  0.499979  0.332568  1
  Cu  Cu17  1  0.026838  0.108544  0.376091  1
  Cu  Cu18  1  0.272629  0.600033  0.398836  1
  Cu  Cu19  1  0.585337  0.225608  0.397179  1
  Cu  Cu20  1  0.339558  0.733896  0.374608  1
  Cu  Cu21  1  0.904039  0.862803  0.364974  1
  Cu  Cu22  1  0.149670  0.354178  0.387416  1
  Cu  Cu23  1  0.959867  0.974481  0.400393  1
  Cu  Cu24  1  0.714094  0.482944  0.377810  1
  Cu  Cu25  1  0.518343  0.091502  0.421668  1
  Cu  Cu26  1  0.764025  0.582828  0.444510  1
  Cu  Cu27  1  0.076799  0.208476  0.442906  1
  Cu  Cu28  1  0.831056  0.716924  0.420257  1
  Cu  Cu29  1  0.395430  0.845628  0.410428  1
  Cu  Cu30  1  0.641148  0.337107  0.433034  1
  Cu  Cu31  1  0.451285  0.957318  0.446015  1
  Cu  Cu32  1  0.205536  0.465817  0.423270  1
  Cu  Cu33  1  0.009768  0.074332  0.467275  1
  Cu  Cu34  1  0.255435  0.565645  0.490151  1
  Cu  Cu35  1  0.568230  0.191307  0.488560  1
  Cu  Cu36  1  0.322475  0.699775  0.465881  1
  Cu  Cu37  1  0.886869  0.828519  0.455976  1
  Cu  Cu38  1  0.132597  0.319984  0.478680  1
  Cu  Cu39  1  0.942695  0.940134  0.491609  1
  Cu  Cu40  1  0.696970  0.448670  0.468832  1
  Cu  Cu41  1  0.501174  0.057134  0.512888  1
  Cu  Cu42  1  0.746853  0.548473  0.535782  1
  Cu  Cu43  1  0.059651  0.174132  0.534164  1
  Cu  Cu44  1  0.813892  0.682610  0.511504  1
  Cu  Cu45  1  0.378284  0.811350  0.501567  1
  Cu  Cu46  1  0.624033  0.302836  0.524328  1
  Cu  Cu47  1  0.434093  0.922932  0.537198  1
  Cu  Cu48  1  0.188400  0.431513  0.514451  1
  Cu  Cu49  1  0.992562  0.039904  0.558499  1
  Cu  Cu50  1  0.238284  0.531321  0.581395  1
  Cu  Cu51  1  0.551062  0.156938  0.579702  1
  Cu  Cu52  1  0.305318  0.665460  0.557128  1
  Cu  Cu53  1  0.869688  0.794160  0.547187  1
  Cu  Cu54  1  0.115472  0.285692  0.569964  1
  Cu  Cu55  1  0.925473  0.905703  0.582785  1
  Cu  Cu56  1  0.679828  0.414342  0.560111  1
  Cu  Cu57  1  0.483911  0.022606  0.604122  1
  Cu  Cu58  1  0.729846  0.514397  0.626958  1
  Cu  Cu59  1  0.042444  0.139689  0.625139  1
  Cu  Cu60  1  0.796777  0.648379  0.602751  1
  Cu  Cu61  1  0.361086  0.776963  0.592857  1
  Cu  Cu62  1  0.606895  0.268509  0.615560  1
  Cu  Cu63  1  0.416852  0.888487  0.628372  1
  Cu  Cu64  1  0.171287  0.397203  0.605835  1
  Cu  Cu65  1  0.975333  0.005467  0.649833  1
  Cu  Cu66  1  0.221170  0.496888  0.672004  1
  Cu  Cu67  1  0.533851  0.122494  0.670365  1
  Cu  Cu68  1  0.288358  0.631556  0.648343  1
  Cu  Cu69  1  0.852384  0.759583  0.638611  1
  Cu  Cu70  1  0.098204  0.251090  0.661080  1
  Cu  Cu71  1  0.908170  0.871185  0.673555  1
  Cu  Cu72  1  0.662610  0.379753  0.651629  1
  Cu  Cu73  1  0.466507  0.987862  0.695029  1
  Cu  Cu74  1  0.712972  0.480055  0.715685  1
  Cu  Cu75  1  0.025654  0.106123  0.714096  1
  Cu  Cu76  1  0.779154  0.613254  0.692962  1
  Cu  Cu77  1  0.343725  0.742321  0.684027  1
  Cu  Cu78  1  0.589555  0.233836  0.705413  1
  Cu  Cu79  1  0.399918  0.854760  0.717364  1
  Cu  Cu80  1  0.153886  0.362243  0.696602  1
