# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.56491635
_cell_length_b   13.02042642
_cell_length_c   48.41358158
_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   Cu84
_cell_volume   2247.20019428
_cell_formula_units_Z   84
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  0.507014  0.528218  0.324438  1
  Cu  Cu2  1  0.507014  0.298792  0.285295  1
  Cu  Cu3  1  0.507014  0.914783  0.304079  1
  Cu  Cu4  1  0.007014  0.414783  0.304079  1
  Cu  Cu5  1  0.007014  0.028218  0.324438  1
  Cu  Cu6  1  0.007014  0.798792  0.285295  1
  Cu  Cu7  1  0.007014  0.607212  0.294398  1
  Cu  Cu8  1  0.007014  0.221397  0.314819  1
  Cu  Cu9  1  0.007014  0.836700  0.335659  1
  Cu  Cu10  1  0.507014  0.336700  0.335659  1
  Cu  Cu11  1  0.507014  0.107212  0.294398  1
  Cu  Cu12  1  0.507014  0.721397  0.314819  1
  Cu  Cu13  1  0.507014  0.374406  0.387448  1
  Cu  Cu14  1  0.507014  0.143901  0.345589  1
  Cu  Cu15  1  0.507014  0.759143  0.366560  1
  Cu  Cu16  1  0.007014  0.259143  0.366560  1
  Cu  Cu17  1  0.007014  0.874406  0.387448  1
  Cu  Cu18  1  0.007014  0.643901  0.345589  1
  Cu  Cu19  1  0.007014  0.451779  0.355880  1
  Cu  Cu20  1  0.007014  0.066530  0.376677  1
  Cu  Cu21  1  0.007014  0.681657  0.397761  1
  Cu  Cu22  1  0.507014  0.181657  0.397761  1
  Cu  Cu23  1  0.507014  0.951779  0.355880  1
  Cu  Cu24  1  0.507014  0.566530  0.376677  1
  Cu  Cu25  1  0.507014  0.219253  0.450000  1
  Cu  Cu26  1  0.507014  0.989339  0.408170  1
  Cu  Cu27  1  0.507014  0.604223  0.429050  1
  Cu  Cu28  1  0.007014  0.104223  0.429050  1
  Cu  Cu29  1  0.007014  0.719253  0.450000  1
  Cu  Cu30  1  0.007014  0.489339  0.408170  1
  Cu  Cu31  1  0.007014  0.296784  0.418722  1
  Cu  Cu32  1  0.007014  0.911852  0.439596  1
  Cu  Cu33  1  0.007014  0.526828  0.460441  1
  Cu  Cu34  1  0.507014  0.026828  0.460441  1
  Cu  Cu35  1  0.507014  0.796784  0.418722  1
  Cu  Cu36  1  0.507014  0.411852  0.439596  1
  Cu  Cu37  1  0.507014  0.064363  0.512703  1
  Cu  Cu38  1  0.507014  0.834313  0.470915  1
  Cu  Cu39  1  0.507014  0.449358  0.491805  1
  Cu  Cu40  1  0.007014  0.949358  0.491805  1
  Cu  Cu41  1  0.007014  0.564363  0.512703  1
  Cu  Cu42  1  0.007014  0.334313  0.470915  1
  Cu  Cu43  1  0.007014  0.141792  0.481332  1
  Cu  Cu44  1  0.007014  0.756798  0.502229  1
  Cu  Cu45  1  0.007014  0.371842  0.523120  1
  Cu  Cu46  1  0.507014  0.871842  0.523120  1
  Cu  Cu47  1  0.507014  0.641792  0.481332  1
  Cu  Cu48  1  0.507014  0.256798  0.502229  1
  Cu  Cu49  1  0.507014  0.909372  0.575313  1
  Cu  Cu50  1  0.507014  0.679328  0.533593  1
  Cu  Cu51  1  0.507014  0.294304  0.554439  1
  Cu  Cu52  1  0.007014  0.794304  0.554439  1
  Cu  Cu53  1  0.007014  0.409372  0.575313  1
  Cu  Cu54  1  0.007014  0.179328  0.533593  1
  Cu  Cu55  1  0.007014  0.986902  0.544035  1
  Cu  Cu56  1  0.007014  0.601932  0.564985  1
  Cu  Cu57  1  0.007014  0.216817  0.585864  1
  Cu  Cu58  1  0.507014  0.716817  0.585864  1
  Cu  Cu59  1  0.507014  0.486902  0.544035  1
  Cu  Cu60  1  0.507014  0.101932  0.564985  1
  Cu  Cu61  1  0.507014  0.754376  0.638155  1
  Cu  Cu62  1  0.507014  0.524499  0.596274  1
  Cu  Cu63  1  0.507014  0.139625  0.617358  1
  Cu  Cu64  1  0.007014  0.639625  0.617358  1
  Cu  Cu65  1  0.007014  0.254376  0.638155  1
  Cu  Cu66  1  0.007014  0.024499  0.596274  1
  Cu  Cu67  1  0.007014  0.831749  0.606587  1
  Cu  Cu68  1  0.007014  0.447012  0.627475  1
  Cu  Cu69  1  0.007014  0.062254  0.648446  1
  Cu  Cu70  1  0.507014  0.562254  0.648446  1
  Cu  Cu71  1  0.507014  0.331749  0.606587  1
  Cu  Cu72  1  0.507014  0.947012  0.627475  1
  Cu  Cu73  1  0.507014  0.598943  0.699636  1
  Cu  Cu74  1  0.507014  0.369456  0.658375  1
  Cu  Cu75  1  0.507014  0.984758  0.679216  1
  Cu  Cu76  1  0.007014  0.484758  0.679216  1
  Cu  Cu77  1  0.007014  0.098943  0.699636  1
  Cu  Cu78  1  0.007014  0.869456  0.658375  1
  Cu  Cu79  1  0.007014  0.677937  0.669597  1
  Cu  Cu80  1  0.007014  0.291372  0.689956  1
  Cu  Cu81  1  0.007014  0.907363  0.708740  1
  Cu  Cu82  1  0.507014  0.407363  0.708740  1
  Cu  Cu83  1  0.507014  0.177937  0.669597  1
  Cu  Cu84  1  0.507014  0.791372  0.689956  1
