# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.38681155
_cell_length_b   12.67433084
_cell_length_c   46.00425980
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   79.99867008
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu
_chemical_formula_sum   Cu96
_cell_volume   2518.96275286
_cell_formula_units_Z   96
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  0.349880  0.984145  0.279629  1
  Cu  Cu2  1  0.178532  0.310988  0.287637  1
  Cu  Cu3  1  0.013432  0.640602  0.296473  1
  Cu  Cu4  1  0.605704  0.147261  0.283244  1
  Cu  Cu5  1  0.438323  0.475794  0.292081  1
  Cu  Cu6  1  0.277686  0.805196  0.300378  1
  Cu  Cu7  1  0.853792  0.969531  0.305173  1
  Cu  Cu8  1  0.684098  0.301364  0.314601  1
  Cu  Cu9  1  0.518927  0.630737  0.323425  1
  Cu  Cu10  1  0.107443  0.136539  0.310186  1
  Cu  Cu11  1  0.942994  0.465964  0.318976  1
  Cu  Cu12  1  0.778755  0.796149  0.327592  1
  Cu  Cu13  1  0.356461  0.960454  0.333300  1
  Cu  Cu14  1  0.191570  0.290730  0.342230  1
  Cu  Cu15  1  0.024982  0.620732  0.351141  1
  Cu  Cu16  1  0.611939  0.124951  0.337512  1
  Cu  Cu17  1  0.446062  0.455824  0.346706  1
  Cu  Cu18  1  0.282240  0.785208  0.355561  1
  Cu  Cu19  1  0.861828  0.950026  0.360534  1
  Cu  Cu20  1  0.696221  0.280196  0.369845  1
  Cu  Cu21  1  0.530385  0.610313  0.378911  1
  Cu  Cu22  1  0.116269  0.115339  0.365326  1
  Cu  Cu23  1  0.951083  0.445392  0.374373  1
  Cu  Cu24  1  0.786685  0.775151  0.383393  1
  Cu  Cu25  1  0.366201  0.939773  0.388497  1
  Cu  Cu26  1  0.201057  0.269986  0.397751  1
  Cu  Cu27  1  0.035436  0.599927  0.406813  1
  Cu  Cu28  1  0.621513  0.104809  0.393090  1
  Cu  Cu29  1  0.456445  0.434948  0.402270  1
  Cu  Cu30  1  0.291661  0.764691  0.411403  1
  Cu  Cu31  1  0.871026  0.929525  0.416240  1
  Cu  Cu32  1  0.706042  0.259564  0.425547  1
  Cu  Cu33  1  0.540618  0.589548  0.434689  1
  Cu  Cu34  1  0.126593  0.094565  0.420952  1
  Cu  Cu35  1  0.961527  0.424627  0.430111  1
  Cu  Cu36  1  0.796651  0.754438  0.439285  1
  Cu  Cu37  1  0.375962  0.919248  0.444125  1
  Cu  Cu38  1  0.211065  0.249246  0.453405  1
  Cu  Cu39  1  0.045779  0.579222  0.462555  1
  Cu  Cu40  1  0.631735  0.084219  0.448773  1
  Cu  Cu41  1  0.466663  0.414244  0.457966  1
  Cu  Cu42  1  0.301753  0.744099  0.467195  1
  Cu  Cu43  1  0.881023  0.908960  0.471960  1
  Cu  Cu44  1  0.716131  0.238892  0.481239  1
  Cu  Cu45  1  0.550950  0.568877  0.490421  1
  Cu  Cu46  1  0.136864  0.073906  0.476632  1
  Cu  Cu47  1  0.971750  0.403907  0.485812  1
  Cu  Cu48  1  0.806850  0.733804  0.495061  1
  Cu  Cu49  1  0.386120  0.898650  0.499840  1
  Cu  Cu50  1  0.221220  0.228547  0.509090  1
  Cu  Cu51  1  0.056105  0.558548  0.518270  1
  Cu  Cu52  1  0.642020  0.063577  0.504480  1
  Cu  Cu53  1  0.476839  0.393561  0.513663  1
  Cu  Cu54  1  0.311947  0.723493  0.522942  1
  Cu  Cu55  1  0.891216  0.888355  0.527706  1
  Cu  Cu56  1  0.726306  0.218210  0.536935  1
  Cu  Cu57  1  0.561235  0.548235  0.546129  1
  Cu  Cu58  1  0.147191  0.053231  0.532346  1
  Cu  Cu59  1  0.981905  0.383208  0.541497  1
  Cu  Cu60  1  0.817008  0.713205  0.550776  1
  Cu  Cu61  1  0.396318  0.878016  0.555616  1
  Cu  Cu62  1  0.231442  0.207827  0.564791  1
  Cu  Cu63  1  0.066376  0.537889  0.573949  1
  Cu  Cu64  1  0.652352  0.042905  0.560213  1
  Cu  Cu65  1  0.486927  0.372890  0.569354  1
  Cu  Cu66  1  0.321944  0.702929  0.578661  1
  Cu  Cu67  1  0.901309  0.867762  0.583498  1
  Cu  Cu68  1  0.736525  0.197506  0.592631  1
  Cu  Cu69  1  0.571457  0.527645  0.601811  1
  Cu  Cu70  1  0.157534  0.032527  0.588088  1
  Cu  Cu71  1  0.991913  0.362468  0.597150  1
  Cu  Cu72  1  0.826768  0.692681  0.606404  1
  Cu  Cu73  1  0.406284  0.857302  0.611508  1
  Cu  Cu74  1  0.241886  0.187062  0.620528  1
  Cu  Cu75  1  0.076701  0.517115  0.629575  1
  Cu  Cu76  1  0.662584  0.022140  0.615990  1
  Cu  Cu77  1  0.496749  0.352258  0.625056  1
  Cu  Cu78  1  0.331141  0.682428  0.634367  1
  Cu  Cu79  1  0.910729  0.847245  0.639340  1
  Cu  Cu80  1  0.746908  0.176629  0.648196  1
  Cu  Cu81  1  0.581031  0.507502  0.657390  1
  Cu  Cu82  1  0.167988  0.011722  0.643760  1
  Cu  Cu83  1  1.001399  0.341724  0.652672  1
  Cu  Cu84  1  0.836509  0.672000  0.661601  1
  Cu  Cu85  1  0.414215  0.836305  0.667310  1
  Cu  Cu86  1  0.249976  0.166489  0.675926  1
  Cu  Cu87  1  0.085527  0.495914  0.684715  1
  Cu  Cu88  1  0.674043  1.001716  0.671476  1
  Cu  Cu89  1  0.508871  0.331089  0.680300  1
  Cu  Cu90  1  0.339178  0.662922  0.689728  1
  Cu  Cu91  1  0.915284  0.827257  0.694523  1
  Cu  Cu92  1  0.754647  0.156660  0.702820  1
  Cu  Cu93  1  0.587266  0.485193  0.711658  1
  Cu  Cu94  1  0.179537  0.991852  0.698429  1
  Cu  Cu95  1  0.014438  0.321466  0.707264  1
  Cu  Cu96  1  0.843090  0.648308  0.715272  1
