# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.38695322
_cell_length_b   16.70284235
_cell_length_c   46.18007185
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   82.44316275
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu
_chemical_formula_sum   Cu128
_cell_volume   3354.43684447
_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  0.880339  0.193335  0.283699  1
  Cu  Cu2  1  0.623932  0.690146  0.296904  1
  Cu  Cu3  1  0.593088  0.069491  0.280325  1
  Cu  Cu4  1  0.338981  0.565788  0.293387  1
  Cu  Cu5  1  0.009446  0.948855  0.278315  1
  Cu  Cu6  1  0.752298  0.441803  0.290328  1
  Cu  Cu7  1  0.165363  0.317777  0.286717  1
  Cu  Cu8  1  0.916607  0.813422  0.299283  1
  Cu  Cu9  1  0.382715  0.187786  0.311136  1
  Cu  Cu10  1  0.128488  0.684210  0.324462  1
  Cu  Cu11  1  0.104242  0.064287  0.308082  1
  Cu  Cu12  1  0.848120  0.560282  0.320886  1
  Cu  Cu13  1  0.508985  0.936488  0.303735  1
  Cu  Cu14  1  0.255071  0.436003  0.317803  1
  Cu  Cu15  1  0.661938  0.311942  0.314186  1
  Cu  Cu16  1  0.410805  0.808523  0.327478  1
  Cu  Cu17  1  0.883678  0.181828  0.338949  1
  Cu  Cu18  1  0.631932  0.678579  0.352287  1
  Cu  Cu19  1  0.609617  0.056490  0.335269  1
  Cu  Cu20  1  0.355804  0.554402  0.348810  1
  Cu  Cu21  1  0.009263  0.932654  0.332266  1
  Cu  Cu22  1  0.758019  0.430197  0.345580  1
  Cu  Cu23  1  0.160124  0.305962  0.342099  1
  Cu  Cu24  1  0.910520  0.802613  0.355488  1
  Cu  Cu25  1  0.386954  0.175550  0.366383  1
  Cu  Cu26  1  0.135426  0.672835  0.379914  1
  Cu  Cu27  1  0.112199  0.051337  0.363069  1
  Cu  Cu28  1  0.860013  0.548651  0.376444  1
  Cu  Cu29  1  0.511538  0.926754  0.359377  1
  Cu  Cu30  1  0.260903  0.424375  0.373164  1
  Cu  Cu31  1  0.661503  0.300142  0.369716  1
  Cu  Cu32  1  0.412601  0.796919  0.383304  1
  Cu  Cu33  1  0.889256  0.169860  0.394279  1
  Cu  Cu34  1  0.638732  0.666964  0.407820  1
  Cu  Cu35  1  0.614755  0.045343  0.390777  1
  Cu  Cu36  1  0.363470  0.542772  0.404368  1
  Cu  Cu37  1  0.013788  0.920902  0.387287  1
  Cu  Cu38  1  0.763921  0.418502  0.401026  1
  Cu  Cu39  1  0.164166  0.294143  0.397587  1
  Cu  Cu40  1  0.915195  0.791017  0.411285  1
  Cu  Cu41  1  0.391997  0.163919  0.422009  1
  Cu  Cu42  1  0.141986  0.661123  0.435649  1
  Cu  Cu43  1  0.117181  0.039548  0.418589  1
  Cu  Cu44  1  0.866794  0.536911  0.432187  1
  Cu  Cu45  1  0.516195  0.915163  0.414988  1
  Cu  Cu46  1  0.266834  0.412617  0.428811  1
  Cu  Cu47  1  0.666711  0.288318  0.425394  1
  Cu  Cu48  1  0.417931  0.785275  0.439149  1
  Cu  Cu49  1  0.894645  0.158080  0.449825  1
  Cu  Cu50  1  0.645112  0.655288  0.463492  1
  Cu  Cu51  1  0.619684  0.033711  0.446364  1
  Cu  Cu52  1  0.369961  0.531042  0.460029  1
  Cu  Cu53  1  0.018779  0.909404  0.442834  1
  Cu  Cu54  1  0.769783  0.406752  0.456627  1
  Cu  Cu55  1  0.169497  0.282416  0.453205  1
  Cu  Cu56  1  0.920821  0.779452  0.467027  1
  Cu  Cu57  1  0.397399  0.152210  0.477612  1
  Cu  Cu58  1  0.148205  0.649451  0.491323  1
  Cu  Cu59  1  0.122284  0.027891  0.474180  1
  Cu  Cu60  1  0.873061  0.525185  0.487849  1
  Cu  Cu61  1  0.521525  0.903623  0.470639  1
  Cu  Cu62  1  0.272698  0.400877  0.484430  1
  Cu  Cu63  1  0.672296  0.276551  0.481016  1
  Cu  Cu64  1  0.423751  0.773656  0.494871  1
  Cu  Cu65  1  0.900167  0.146349  0.505424  1
  Cu  Cu66  1  0.651261  0.643620  0.519142  1
  Cu  Cu67  1  0.624942  0.022056  0.501990  1
  Cu  Cu68  1  0.376108  0.519330  0.515671  1
  Cu  Cu69  1  0.024350  0.897820  0.498485  1
  Cu  Cu70  1  0.775607  0.395005  0.512235  1
  Cu  Cu71  1  0.175146  0.270676  0.508824  1
  Cu  Cu72  1  0.926712  0.767851  0.522722  1
  Cu  Cu73  1  0.402953  0.140490  0.533225  1
  Cu  Cu74  1  0.154283  0.637803  0.546959  1
  Cu  Cu75  1  0.127619  0.016211  0.529822  1
  Cu  Cu76  1  0.879125  0.513465  0.543473  1
  Cu  Cu77  1  0.527222  0.892026  0.526323  1
  Cu  Cu78  1  0.278512  0.389138  0.540034  1
  Cu  Cu79  1  0.678026  0.264797  0.536633  1
  Cu  Cu80  1  0.429702  0.762058  0.550541  1
  Cu  Cu81  1  0.905779  0.134615  0.561050  1
  Cu  Cu82  1  0.657353  0.631955  0.574750  1
  Cu  Cu83  1  0.630279  0.010381  0.557659  1
  Cu  Cu84  1  0.382071  0.507617  0.571296  1
  Cu  Cu85  1  0.030113  0.886202  0.554202  1
  Cu  Cu86  1  0.781394  0.383241  0.567836  1
  Cu  Cu87  1  0.180952  0.258927  0.564453  1
  Cu  Cu88  1  0.932660  0.756293  0.578401  1
  Cu  Cu89  1  0.408548  0.128780  0.588833  1
  Cu  Cu90  1  0.160272  0.626153  0.602543  1
  Cu  Cu91  1  0.132794  0.004514  0.585509  1
  Cu  Cu92  1  0.884937  0.501684  0.599059  1
  Cu  Cu93  1  0.532992  0.880472  0.582051  1
  Cu  Cu94  1  0.284321  0.377375  0.595610  1
  Cu  Cu95  1  0.684027  0.253032  0.592256  1
  Cu  Cu96  1  0.435703  0.750492  0.606135  1
  Cu  Cu97  1  0.911431  0.122874  0.616719  1
  Cu  Cu98  1  0.663427  0.620076  0.630304  1
  Cu  Cu99  1  0.635240  0.998716  0.613405  1
  Cu  Cu100  1  0.387462  0.495872  0.626950  1
  Cu  Cu101  1  0.035923  0.874561  0.610045  1
  Cu  Cu102  1  0.787140  0.371436  0.623456  1
  Cu  Cu103  1  0.187223  0.247153  0.620146  1
  Cu  Cu104  1  0.938638  0.744640  0.634073  1
  Cu  Cu105  1  0.414055  0.117266  0.644280  1
  Cu  Cu106  1  0.165787  0.614764  0.657950  1
  Cu  Cu107  1  0.136987  0.992840  0.641128  1
  Cu  Cu108  1  0.889905  0.489738  0.654511  1
  Cu  Cu109  1  0.539089  0.868964  0.637776  1
  Cu  Cu110  1  0.290277  0.365438  0.651001  1
  Cu  Cu111  1  0.691465  0.241266  0.647782  1
  Cu  Cu112  1  0.443057  0.738886  0.661237  1
  Cu  Cu113  1  0.917395  0.111331  0.672112  1
  Cu  Cu114  1  0.669808  0.607536  0.685420  1
  Cu  Cu115  1  0.635685  0.987530  0.668897  1
  Cu  Cu116  1  0.387811  0.483455  0.682255  1
  Cu  Cu117  1  0.043473  0.862610  0.665858  1
  Cu  Cu118  1  0.793533  0.359485  0.678784  1
  Cu  Cu119  1  0.198867  0.235404  0.675699  1
  Cu  Cu120  1  0.945436  0.733865  0.689815  1
  Cu  Cu121  1  0.420086  0.105527  0.699568  1
  Cu  Cu122  1  0.171287  0.600316  0.712785  1
  Cu  Cu123  1  0.130712  0.981436  0.696712  1
  Cu  Cu124  1  0.882663  0.477369  0.709922  1
  Cu  Cu125  1  0.546030  0.859106  0.693768  1
  Cu  Cu126  1  0.296556  0.353855  0.706262  1
  Cu  Cu127  1  0.708041  0.229586  0.703190  1
  Cu  Cu128  1  0.445668  0.724922  0.715114  1
