# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.19765562
_cell_length_b   11.12103586
_cell_length_c   47.54624995
_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   2219.567292
_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  0.251591  0.515792  0.298827  1
  Cu  Cu2  1  0.251591  0.302582  0.279064  1
  Cu  Cu3  1  0.251591  0.910796  0.288786  1
  Cu  Cu4  1  0.751591  0.385239  0.301818  1
  Cu  Cu5  1  0.751591  0.174640  0.281893  1
  Cu  Cu6  1  0.751591  0.780144  0.292259  1
  Cu  Cu7  1  0.251591  0.332160  0.330272  1
  Cu  Cu8  1  0.251591  0.120483  0.309078  1
  Cu  Cu9  1  0.251591  0.726591  0.319311  1
  Cu  Cu10  1  0.751591  0.200884  0.333637  1
  Cu  Cu11  1  0.751591  0.988823  0.312415  1
  Cu  Cu12  1  0.751591  0.594044  0.322805  1
  Cu  Cu13  1  0.251591  0.148107  0.362435  1
  Cu  Cu14  1  0.251591  0.936513  0.340912  1
  Cu  Cu15  1  0.251591  0.543402  0.351477  1
  Cu  Cu16  1  0.751591  0.015606  0.365957  1
  Cu  Cu17  1  0.751591  0.804737  0.344385  1
  Cu  Cu18  1  0.751591  0.411142  0.355087  1
  Cu  Cu19  1  0.251591  0.964348  0.394713  1
  Cu  Cu20  1  0.251591  0.753556  0.373090  1
  Cu  Cu21  1  0.251591  0.359400  0.383882  1
  Cu  Cu22  1  0.751591  0.831173  0.398323  1
  Cu  Cu23  1  0.751591  0.620718  0.376691  1
  Cu  Cu24  1  0.751591  0.226321  0.387556  1
  Cu  Cu25  1  0.251591  0.780401  0.427041  1
  Cu  Cu26  1  0.251591  0.569894  0.405419  1
  Cu  Cu27  1  0.251591  0.175197  0.416264  1
  Cu  Cu28  1  0.751591  0.647092  0.430735  1
  Cu  Cu29  1  0.751591  0.436650  0.409161  1
  Cu  Cu30  1  0.751591  0.041888  0.419934  1
  Cu  Cu31  1  0.251591  0.596284  0.459402  1
  Cu  Cu32  1  0.251591  0.385789  0.437819  1
  Cu  Cu33  1  0.251591  0.991024  0.448626  1
  Cu  Cu34  1  0.751591  0.462958  0.463149  1
  Cu  Cu35  1  0.751591  0.252441  0.441553  1
  Cu  Cu36  1  0.751591  0.857675  0.452323  1
  Cu  Cu37  1  0.251591  0.412116  0.491796  1
  Cu  Cu38  1  0.251591  0.201596  0.470208  1
  Cu  Cu39  1  0.251591  0.806832  0.480992  1
  Cu  Cu40  1  0.751591  0.278760  0.495527  1
  Cu  Cu41  1  0.751591  0.068228  0.473925  1
  Cu  Cu42  1  0.751591  0.673500  0.484726  1
  Cu  Cu43  1  0.251591  0.227919  0.524182  1
  Cu  Cu44  1  0.251591  0.017387  0.502580  1
  Cu  Cu45  1  0.251591  0.622646  0.513382  1
  Cu  Cu46  1  0.751591  0.094550  0.527899  1
  Cu  Cu47  1  0.751591  0.884030  0.506311  1
  Cu  Cu48  1  0.751591  0.489315  0.517116  1
  Cu  Cu49  1  0.251591  0.043705  0.556555  1
  Cu  Cu50  1  0.251591  0.833189  0.534959  1
  Cu  Cu51  1  0.251591  0.438471  0.545784  1
  Cu  Cu52  1  0.751591  0.910358  0.560288  1
  Cu  Cu53  1  0.751591  0.699862  0.538706  1
  Cu  Cu54  1  0.751591  0.305122  0.549481  1
  Cu  Cu55  1  0.251591  0.859496  0.588947  1
  Cu  Cu56  1  0.251591  0.649055  0.567373  1
  Cu  Cu57  1  0.251591  0.254258  0.578174  1
  Cu  Cu58  1  0.751591  0.726252  0.592688  1
  Cu  Cu59  1  0.751591  0.515745  0.571066  1
  Cu  Cu60  1  0.751591  0.120949  0.581843  1
  Cu  Cu61  1  0.251591  0.675429  0.621416  1
  Cu  Cu62  1  0.251591  0.464974  0.599785  1
  Cu  Cu63  1  0.251591  0.069825  0.610551  1
  Cu  Cu64  1  0.751591  0.542591  0.625017  1
  Cu  Cu65  1  0.751591  0.331798  0.603394  1
  Cu  Cu66  1  0.751591  0.936747  0.614225  1
  Cu  Cu67  1  0.251591  0.491409  0.653723  1
  Cu  Cu68  1  0.251591  0.280541  0.632151  1
  Cu  Cu69  1  0.251591  0.885004  0.643021  1
  Cu  Cu70  1  0.751591  0.359633  0.657195  1
  Cu  Cu71  1  0.751591  0.148040  0.635672  1
  Cu  Cu72  1  0.751591  0.752744  0.646631  1
  Cu  Cu73  1  0.251591  0.307323  0.685692  1
  Cu  Cu74  1  0.251591  0.095263  0.664470  1
  Cu  Cu75  1  0.251591  0.702103  0.675302  1
  Cu  Cu76  1  0.751591  0.175663  0.689030  1
  Cu  Cu77  1  0.751591  0.963987  0.667836  1
  Cu  Cu78  1  0.751591  0.569555  0.678796  1
  Cu  Cu79  1  0.251591  0.121506  0.716214  1
  Cu  Cu80  1  0.251591  0.910908  0.696289  1
  Cu  Cu81  1  0.251591  0.516002  0.705848  1
  Cu  Cu82  1  0.751591  0.993564  0.719044  1
  Cu  Cu83  1  0.751591  0.780354  0.699280  1
  Cu  Cu84  1  0.751591  0.385350  0.709322  1
