# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.38637414
_cell_length_b   16.77934388
_cell_length_c   46.11154886
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   97.54018935
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu
_chemical_formula_sum   Cu128
_cell_volume   3364.48587355
_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  0.952608  0.946418  0.278987  1
  Cu  Cu2  1  0.194426  0.440729  0.291538  1
  Cu  Cu3  1  0.667643  0.067992  0.281612  1
  Cu  Cu4  1  0.913348  0.564853  0.294863  1
  Cu  Cu5  1  0.072124  0.192066  0.284882  1
  Cu  Cu6  1  0.317970  0.689040  0.298211  1
  Cu  Cu7  1  0.475375  0.316529  0.288118  1
  Cu  Cu8  1  0.726347  0.813330  0.300926  1
  Cu  Cu9  1  0.445006  0.936674  0.304654  1
  Cu  Cu10  1  0.691475  0.435086  0.318405  1
  Cu  Cu11  1  0.168082  0.062867  0.308594  1
  Cu  Cu12  1  0.411624  0.559349  0.321688  1
  Cu  Cu13  1  0.569263  0.186758  0.311719  1
  Cu  Cu14  1  0.815180  0.683527  0.325105  1
  Cu  Cu15  1  0.971571  0.310917  0.314908  1
  Cu  Cu16  1  0.219653  0.807976  0.328132  1
  Cu  Cu17  1  0.941027  0.932033  0.332717  1
  Cu  Cu18  1  0.188466  0.429319  0.346100  1
  Cu  Cu19  1  0.665130  0.055890  0.335882  1
  Cu  Cu20  1  0.911072  0.553568  0.349438  1
  Cu  Cu21  1  0.065008  0.180855  0.339425  1
  Cu  Cu22  1  0.311899  0.677827  0.352832  1
  Cu  Cu23  1  0.465837  0.305076  0.342674  1
  Cu  Cu24  1  0.714119  0.801813  0.356093  1
  Cu  Cu25  1  0.437630  0.925987  0.359967  1
  Cu  Cu26  1  0.685450  0.423531  0.373799  1
  Cu  Cu27  1  0.162313  0.050549  0.363691  1
  Cu  Cu28  1  0.408617  0.547803  0.377148  1
  Cu  Cu29  1  0.561933  0.174770  0.367001  1
  Cu  Cu30  1  0.809072  0.671987  0.380577  1
  Cu  Cu31  1  0.962016  0.299268  0.370365  1
  Cu  Cu32  1  0.210481  0.796165  0.383938  1
  Cu  Cu33  1  0.934258  0.920239  0.387918  1
  Cu  Cu34  1  0.182479  0.417669  0.401686  1
  Cu  Cu35  1  0.658734  0.044586  0.391438  1
  Cu  Cu36  1  0.905775  0.541940  0.405075  1
  Cu  Cu37  1  0.058623  0.169058  0.394911  1
  Cu  Cu38  1  0.306171  0.666179  0.408496  1
  Cu  Cu39  1  0.458897  0.293337  0.398254  1
  Cu  Cu40  1  0.707205  0.790296  0.411947  1
  Cu  Cu41  1  0.430998  0.914490  0.415661  1
  Cu  Cu42  1  0.679436  0.411818  0.429521  1
  Cu  Cu43  1  0.155350  0.038837  0.419287  1
  Cu  Cu44  1  0.402931  0.536113  0.432922  1
  Cu  Cu45  1  0.555489  0.163167  0.422695  1
  Cu  Cu46  1  0.803338  0.660347  0.436368  1
  Cu  Cu47  1  0.955757  0.287535  0.426098  1
  Cu  Cu48  1  0.204153  0.784559  0.439836  1
  Cu  Cu49  1  0.927879  0.908730  0.443542  1
  Cu  Cu50  1  0.176453  0.405986  0.457376  1
  Cu  Cu51  1  0.652033  0.033018  0.447095  1
  Cu  Cu52  1  0.900054  0.530272  0.460793  1
  Cu  Cu53  1  0.052343  0.157362  0.450551  1
  Cu  Cu54  1  0.300470  0.654538  0.464237  1
  Cu  Cu55  1  0.452689  0.281672  0.453946  1
  Cu  Cu56  1  0.701161  0.778748  0.467746  1
  Cu  Cu57  1  0.424864  0.902957  0.471376  1
  Cu  Cu58  1  0.673443  0.400147  0.485221  1
  Cu  Cu59  1  0.148818  0.027221  0.474947  1
  Cu  Cu60  1  0.397181  0.524446  0.488643  1
  Cu  Cu61  1  0.549257  0.151526  0.478380  1
  Cu  Cu62  1  0.797614  0.648721  0.492103  1
  Cu  Cu63  1  0.949639  0.275844  0.481794  1
  Cu  Cu64  1  0.198230  0.772966  0.495614  1
  Cu  Cu65  1  0.921884  0.897166  0.499254  1
  Cu  Cu66  1  0.170442  0.394311  0.513067  1
  Cu  Cu67  1  0.645643  0.021412  0.502791  1
  Cu  Cu68  1  0.894295  0.518620  0.516501  1
  Cu  Cu69  1  0.046179  0.145700  0.506232  1
  Cu  Cu70  1  0.294756  0.642909  0.519952  1
  Cu  Cu71  1  0.446607  0.270006  0.509643  1
  Cu  Cu72  1  0.695310  0.767173  0.523494  1
  Cu  Cu73  1  0.418941  0.891387  0.527117  1
  Cu  Cu74  1  0.667451  0.388482  0.540911  1
  Cu  Cu75  1  0.142466  0.015591  0.530657  1
  Cu  Cu76  1  0.391406  0.512786  0.544338  1
  Cu  Cu77  1  0.543106  0.139872  0.534076  1
  Cu  Cu78  1  0.791899  0.637113  0.547808  1
  Cu  Cu79  1  0.943576  0.264164  0.537490  1
  Cu  Cu80  1  0.192412  0.761395  0.551331  1
  Cu  Cu81  1  0.915958  0.885575  0.555023  1
  Cu  Cu82  1  0.164409  0.382629  0.568752  1
  Cu  Cu83  1  0.639282  0.009785  0.558528  1
  Cu  Cu84  1  0.888500  0.506980  0.572203  1
  Cu  Cu85  1  0.040042  0.134028  0.561938  1
  Cu  Cu86  1  0.289067  0.631288  0.575628  1
  Cu  Cu87  1  0.440562  0.258330  0.565349  1
  Cu  Cu88  1  0.689461  0.755637  0.579216  1
  Cu  Cu89  1  0.413005  0.879843  0.582899  1
  Cu  Cu90  1  0.661444  0.376812  0.596584  1
  Cu  Cu91  1  0.135958  0.003931  0.586411  1
  Cu  Cu92  1  0.385537  0.501098  0.600006  1
  Cu  Cu93  1  0.536933  0.128199  0.589776  1
  Cu  Cu94  1  0.786188  0.625546  0.603478  1
  Cu  Cu95  1  0.937554  0.252470  0.593187  1
  Cu  Cu96  1  0.186508  0.749871  0.606960  1
  Cu  Cu97  1  0.909848  0.873966  0.610908  1
  Cu  Cu98  1  0.158313  0.370932  0.624450  1
  Cu  Cu99  1  0.632654  0.998138  0.614339  1
  Cu  Cu100  1  0.882446  0.495362  0.627931  1
  Cu  Cu101  1  0.033839  0.122313  0.617682  1
  Cu  Cu102  1  0.283326  0.619554  0.631253  1
  Cu  Cu103  1  0.434572  0.246606  0.621092  1
  Cu  Cu104  1  0.683353  0.744153  0.634923  1
  Cu  Cu105  1  0.406922  0.868346  0.638706  1
  Cu  Cu106  1  0.655390  0.365036  0.652120  1
  Cu  Cu107  1  0.128792  0.992238  0.642123  1
  Cu  Cu108  1  0.379106  0.489333  0.655568  1
  Cu  Cu109  1  0.530720  0.116551  0.645378  1
  Cu  Cu110  1  0.780052  0.614219  0.659016  1
  Cu  Cu111  1  0.932173  0.240775  0.648791  1
  Cu  Cu112  1  0.181083  0.738123  0.662158  1
  Cu  Cu113  1  0.904034  0.862022  0.666705  1
  Cu  Cu114  1  0.152435  0.359177  0.679800  1
  Cu  Cu115  1  0.623794  0.986619  0.669857  1
  Cu  Cu116  1  0.872829  0.483372  0.683264  1
  Cu  Cu117  1  0.027858  0.110827  0.673086  1
  Cu  Cu118  1  0.276566  0.607456  0.686432  1
  Cu  Cu119  1  0.431768  0.234999  0.676544  1
  Cu  Cu120  1  0.677358  0.733051  0.690243  1
  Cu  Cu121  1  0.399673  0.857062  0.693798  1
  Cu  Cu122  1  0.649729  0.353610  0.706677  1
  Cu  Cu123  1  0.119512  0.981163  0.696776  1
  Cu  Cu124  1  0.367960  0.477506  0.710123  1
  Cu  Cu125  1  0.525070  0.105276  0.699950  1
  Cu  Cu126  1  0.770849  0.601413  0.713274  1
  Cu  Cu127  1  0.930045  0.229415  0.703364  1
  Cu  Cu128  1  0.169699  0.724631  0.715823  1
