# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.35961757
_cell_length_b   16.97326423
_cell_length_c   46.16659495
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   97.41720072
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu
_chemical_formula_sum   Cu128
_cell_volume   3387.60169616
_cell_formula_units_Z   128
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  0.068248  0.195410  0.282987  1
  Cu  Cu2  1  0.321041  0.691048  0.295964  1
  Cu  Cu3  1  0.782838  0.319526  0.286262  1
  Cu  Cu4  1  0.031077  0.816030  0.298349  1
  Cu  Cu5  1  0.941213  0.950744  0.277397  1
  Cu  Cu6  1  0.195991  0.443537  0.289517  1
  Cu  Cu7  1  0.354569  0.071719  0.279965  1
  Cu  Cu8  1  0.609127  0.567394  0.292858  1
  Cu  Cu9  1  0.566150  0.190070  0.310088  1
  Cu  Cu10  1  0.819094  0.686416  0.323078  1
  Cu  Cu11  1  0.284399  0.314107  0.313131  1
  Cu  Cu12  1  0.534341  0.810675  0.325760  1
  Cu  Cu13  1  0.439716  0.938796  0.302608  1
  Cu  Cu14  1  0.693424  0.438073  0.316633  1
  Cu  Cu15  1  0.846193  0.066481  0.307035  1
  Cu  Cu16  1  0.102125  0.562146  0.319796  1
  Cu  Cu17  1  0.065370  0.184098  0.337944  1
  Cu  Cu18  1  0.316521  0.681101  0.351018  1
  Cu  Cu19  1  0.786021  0.308307  0.341138  1
  Cu  Cu20  1  0.034890  0.805223  0.354017  1
  Cu  Cu21  1  0.939088  0.935017  0.331154  1
  Cu  Cu22  1  0.190918  0.432549  0.344513  1
  Cu  Cu23  1  0.341746  0.058598  0.334360  1
  Cu  Cu24  1  0.595851  0.556845  0.347761  1
  Cu  Cu25  1  0.562289  0.178056  0.365269  1
  Cu  Cu26  1  0.813733  0.675646  0.378579  1
  Cu  Cu27  1  0.284841  0.302768  0.368590  1
  Cu  Cu28  1  0.533539  0.799819  0.381778  1
  Cu  Cu29  1  0.437535  0.929279  0.358130  1
  Cu  Cu30  1  0.688337  0.427070  0.372004  1
  Cu  Cu31  1  0.839733  0.053921  0.362012  1
  Cu  Cu32  1  0.092207  0.551405  0.375254  1
  Cu  Cu33  1  0.060277  0.172696  0.393244  1
  Cu  Cu34  1  0.310944  0.670036  0.406577  1
  Cu  Cu35  1  0.782380  0.296988  0.396524  1
  Cu  Cu36  1  0.031388  0.794126  0.409917  1
  Cu  Cu37  1  0.935698  0.923843  0.386205  1
  Cu  Cu38  1  0.185561  0.421428  0.399932  1
  Cu  Cu39  1  0.337558  0.048153  0.389779  1
  Cu  Cu40  1  0.589072  0.545771  0.403244  1
  Cu  Cu41  1  0.557759  0.167049  0.420964  1
  Cu  Cu42  1  0.808029  0.664442  0.434420  1
  Cu  Cu43  1  0.280127  0.291490  0.424314  1
  Cu  Cu44  1  0.529076  0.788676  0.437812  1
  Cu  Cu45  1  0.433572  0.918301  0.413853  1
  Cu  Cu46  1  0.682960  0.415814  0.427709  1
  Cu  Cu47  1  0.835410  0.042688  0.417587  1
  Cu  Cu48  1  0.086063  0.540180  0.431041  1
  Cu  Cu49  1  0.055383  0.161497  0.448830  1
  Cu  Cu50  1  0.305205  0.658873  0.462313  1
  Cu  Cu51  1  0.777615  0.285858  0.452171  1
  Cu  Cu52  1  0.026509  0.783094  0.465776  1
  Cu  Cu53  1  0.931243  0.912811  0.441782  1
  Cu  Cu54  1  0.180298  0.410229  0.455570  1
  Cu  Cu55  1  0.333189  0.037101  0.445390  1
  Cu  Cu56  1  0.583173  0.534563  0.458931  1
  Cu  Cu57  1  0.552872  0.155910  0.476628  1
  Cu  Cu58  1  0.802365  0.653298  0.490169  1
  Cu  Cu59  1  0.275086  0.280281  0.479995  1
  Cu  Cu60  1  0.523880  0.777573  0.493640  1
  Cu  Cu61  1  0.428727  0.907292  0.469589  1
  Cu  Cu62  1  0.677674  0.404634  0.483387  1
  Cu  Cu63  1  0.830880  0.031566  0.473227  1
  Cu  Cu64  1  0.080353  0.528985  0.486760  1
  Cu  Cu65  1  0.050345  0.150330  0.504482  1
  Cu  Cu66  1  0.299564  0.647726  0.518020  1
  Cu  Cu67  1  0.772474  0.274683  0.507844  1
  Cu  Cu68  1  0.021202  0.772024  0.521543  1
  Cu  Cu69  1  0.926109  0.901747  0.497494  1
  Cu  Cu70  1  0.175048  0.399039  0.511227  1
  Cu  Cu71  1  0.328516  0.026005  0.501068  1
  Cu  Cu72  1  0.577597  0.523398  0.514624  1
  Cu  Cu73  1  0.547793  0.144754  0.532302  1
  Cu  Cu74  1  0.796830  0.642182  0.545864  1
  Cu  Cu75  1  0.269809  0.269083  0.535667  1
  Cu  Cu76  1  0.518509  0.766501  0.549344  1
  Cu  Cu77  1  0.423433  0.896229  0.525353  1
  Cu  Cu78  1  0.672416  0.393454  0.539045  1
  Cu  Cu79  1  0.826152  0.020429  0.528923  1
  Cu  Cu80  1  0.074887  0.517802  0.542437  1
  Cu  Cu81  1  0.045163  0.139142  0.560183  1
  Cu  Cu82  1  0.294055  0.636583  0.573690  1
  Cu  Cu83  1  0.767085  0.263493  0.563546  1
  Cu  Cu84  1  0.015946  0.760998  0.577257  1
  Cu  Cu85  1  0.920723  0.890641  0.553310  1
  Cu  Cu86  1  0.169817  0.387829  0.566892  1
  Cu  Cu87  1  0.323808  0.014870  0.556813  1
  Cu  Cu88  1  0.572294  0.512234  0.570318  1
  Cu  Cu89  1  0.542604  0.133555  0.587976  1
  Cu  Cu90  1  0.791521  0.631075  0.601500  1
  Cu  Cu91  1  0.264247  0.257859  0.591331  1
  Cu  Cu92  1  0.513373  0.755443  0.604886  1
  Cu  Cu93  1  0.418020  0.885191  0.581188  1
  Cu  Cu94  1  0.667176  0.382287  0.594677  1
  Cu  Cu95  1  0.821621  0.009240  0.584664  1
  Cu  Cu96  1  0.069815  0.506593  0.598065  1
  Cu  Cu97  1  0.039896  0.127852  0.615948  1
  Cu  Cu98  1  0.288708  0.625340  0.629332  1
  Cu  Cu99  1  0.761297  0.252238  0.619303  1
  Cu  Cu100  1  0.011201  0.749925  0.632919  1
  Cu  Cu101  1  0.915228  0.879455  0.609312  1
  Cu  Cu102  1  0.164676  0.376622  0.622587  1
  Cu  Cu103  1  0.319467  1.003672  0.612661  1
  Cu  Cu104  1  0.567671  0.501158  0.626060  1
  Cu  Cu105  1  0.537471  0.122470  0.643437  1
  Cu  Cu106  1  0.786759  0.620452  0.656930  1
  Cu  Cu107  1  0.257433  0.246622  0.646774  1
  Cu  Cu108  1  0.507992  0.744514  0.659865  1
  Cu  Cu109  1  0.412384  0.874152  0.637036  1
  Cu  Cu110  1  0.661774  0.370940  0.650044  1
  Cu  Cu111  1  0.817872  0.998004  0.640258  1
  Cu  Cu112  1  0.065433  0.495324  0.653453  1
  Cu  Cu113  1  0.034373  0.116860  0.671364  1
  Cu  Cu114  1  0.283479  0.613728  0.684473  1
  Cu  Cu115  1  0.750938  0.241071  0.674776  1
  Cu  Cu116  1  1.006909  0.739504  0.688333  1
  Cu  Cu117  1  0.908720  0.868032  0.665286  1
  Cu  Cu118  1  0.158837  0.365192  0.677903  1
  Cu  Cu119  1  0.318489  0.992994  0.668184  1
  Cu  Cu120  1  0.566967  0.489378  0.681333  1
  Cu  Cu121  1  0.532040  0.111572  0.698432  1
  Cu  Cu122  1  0.783250  0.606854  0.711475  1
  Cu  Cu123  1  0.244247  0.235660  0.701639  1
  Cu  Cu124  1  0.506980  0.730477  0.713465  1
  Cu  Cu125  1  0.406859  0.864236  0.692728  1
  Cu  Cu126  1  0.656021  0.359839  0.704990  1
  Cu  Cu127  1  0.820308  0.987283  0.695271  1
  Cu  Cu128  1  0.069732  0.483578  0.708280  1
