# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.08793213
_cell_length_b   8.94368406
_cell_length_c   47.70430467
_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   1699.96311541
_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  0.241813  0.840648  0.278179  1
  Cu  Cu2  1  0.392618  0.149449  0.292439  1
  Cu  Cu3  1  0.542169  0.458459  0.306765  1
  Cu  Cu4  1  0.661407  0.678119  0.273792  1
  Cu  Cu5  1  0.815390  0.991172  0.285890  1
  Cu  Cu6  1  0.968560  0.305678  0.298293  1
  Cu  Cu7  1  0.694877  0.778092  0.321036  1
  Cu  Cu8  1  0.846037  0.094264  0.333949  1
  Cu  Cu9  1  0.996720  0.408733  0.346896  1
  Cu  Cu10  1  0.120483  0.619571  0.310777  1
  Cu  Cu11  1  0.271101  0.936970  0.326887  1
  Cu  Cu12  1  0.419782  0.249093  0.341366  1
  Cu  Cu13  1  0.145897  0.721281  0.360582  1
  Cu  Cu14  1  0.295140  0.037285  0.375763  1
  Cu  Cu15  1  0.444345  0.352262  0.389884  1
  Cu  Cu16  1  0.569856  0.563407  0.355060  1
  Cu  Cu17  1  0.720497  0.880227  0.369084  1
  Cu  Cu18  1  0.870597  0.196143  0.382447  1
  Cu  Cu19  1  0.593502  0.666450  0.403593  1
  Cu  Cu20  1  0.743408  0.982378  0.417461  1
  Cu  Cu21  1  0.892782  0.297711  0.431134  1
  Cu  Cu22  1  0.019728  0.510095  0.395931  1
  Cu  Cu23  1  0.168523  0.823598  0.409858  1
  Cu  Cu24  1  0.317825  0.139652  0.424377  1
  Cu  Cu25  1  0.041837  0.611973  0.444862  1
  Cu  Cu26  1  0.190925  0.926319  0.458750  1
  Cu  Cu27  1  0.340252  0.241788  0.472990  1
  Cu  Cu28  1  0.466923  0.454646  0.438457  1
  Cu  Cu29  1  0.616121  0.769159  0.452208  1
  Cu  Cu30  1  0.765666  0.084350  0.466051  1
  Cu  Cu31  1  0.489546  0.557056  0.487092  1
  Cu  Cu32  1  0.638753  0.871528  0.500923  1
  Cu  Cu33  1  0.788092  0.186296  0.514733  1
  Cu  Cu34  1  0.914998  0.399489  0.479851  1
  Cu  Cu35  1  0.064336  0.714258  0.493661  1
  Cu  Cu36  1  0.213543  0.028729  0.507492  1
  Cu  Cu37  1  0.937424  0.501435  0.528533  1
  Cu  Cu38  1  0.086968  0.816626  0.542376  1
  Cu  Cu39  1  0.236167  0.131140  0.556127  1
  Cu  Cu40  1  0.362837  0.343997  0.521594  1
  Cu  Cu41  1  0.512165  0.659466  0.535834  1
  Cu  Cu42  1  0.661252  0.973812  0.549721  1
  Cu  Cu43  1  0.385264  0.446133  0.570206  1
  Cu  Cu44  1  0.534567  0.762187  0.584726  1
  Cu  Cu45  1  0.683362  0.075691  0.598653  1
  Cu  Cu46  1  0.810308  0.288074  0.563449  1
  Cu  Cu47  1  0.959682  0.603407  0.577123  1
  Cu  Cu48  1  0.109587  0.919335  0.590991  1
  Cu  Cu49  1  0.832493  0.389642  0.612137  1
  Cu  Cu50  1  0.982592  0.705558  0.625500  1
  Cu  Cu51  1  0.133233  0.022378  0.639524  1
  Cu  Cu52  1  0.258744  0.233523  0.604700  1
  Cu  Cu53  1  0.407949  0.548500  0.618821  1
  Cu  Cu54  1  0.557193  0.864504  0.634002  1
  Cu  Cu55  1  0.283307  0.336692  0.653218  1
  Cu  Cu56  1  0.431988  0.648816  0.667696  1
  Cu  Cu57  1  0.582606  0.966214  0.683806  1
  Cu  Cu58  1  0.706369  0.177053  0.647688  1
  Cu  Cu59  1  0.857052  0.491521  0.660634  1
  Cu  Cu60  1  0.008213  0.807693  0.673548  1
  Cu  Cu61  1  0.734530  0.280107  0.696291  1
  Cu  Cu62  1  0.887700  0.594613  0.708694  1
  Cu  Cu63  1  0.041682  0.907666  0.720792  1
  Cu  Cu64  1  0.160920  0.127327  0.687819  1
  Cu  Cu65  1  0.310471  0.436336  0.702145  1
  Cu  Cu66  1  0.461276  0.745138  0.716405  1
