# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.71168920
_cell_length_b   25.02449812
_cell_length_c   50.15527315
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   91.10088326
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu
_chemical_formula_sum   Cu324
_cell_volume   8422.35692574
_cell_formula_units_Z   324
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  0.438665  0.606868  0.307306  1
  Cu  Cu2  1  0.417332  0.277113  0.290939  1
  Cu  Cu3  1  0.388787  0.947055  0.275793  1
  Cu  Cu4  1  0.776454  0.273942  0.306458  1
  Cu  Cu5  1  0.749512  0.944124  0.290489  1
  Cu  Cu6  1  0.105727  0.940199  0.307288  1
  Cu  Cu7  1  0.721726  0.613732  0.275824  1
  Cu  Cu8  1  0.082404  0.610809  0.290507  1
  Cu  Cu9  1  0.129606  0.271005  0.322963  1
  Cu  Cu10  1  0.653691  0.525004  0.296858  1
  Cu  Cu11  1  0.623262  0.195355  0.282052  1
  Cu  Cu12  1  0.673975  0.856709  0.313553  1
  Cu  Cu13  1  0.987433  0.192391  0.296831  1
  Cu  Cu14  1  0.960269  0.862873  0.281708  1
  Cu  Cu15  1  0.320944  0.858368  0.296836  1
  Cu  Cu16  1  0.006850  0.523477  0.313630  1
  Cu  Cu17  1  0.293360  0.529521  0.281750  1
  Cu  Cu18  1  0.340701  0.189438  0.313944  1
  Cu  Cu19  1  0.429061  0.441377  0.298213  1
  Cu  Cu20  1  0.400476  0.112537  0.283199  1
  Cu  Cu21  1  0.451204  0.772191  0.315376  1
  Cu  Cu22  1  0.763853  0.108485  0.298218  1
  Cu  Cu23  1  0.734326  0.779701  0.283166  1
  Cu  Cu24  1  0.096505  0.775077  0.298210  1
  Cu  Cu25  1  0.783659  0.439191  0.315568  1
  Cu  Cu26  1  0.067288  0.446704  0.283299  1
  Cu  Cu27  1  0.117468  0.105658  0.315302  1
  Cu  Cu28  1  0.560243  0.355011  0.316638  1
  Cu  Cu29  1  0.539033  0.025609  0.299895  1
  Cu  Cu30  1  0.513268  0.695134  0.284458  1
  Cu  Cu31  1  0.894224  0.021763  0.316644  1
  Cu  Cu32  1  0.871835  0.692371  0.299910  1
  Cu  Cu33  1  0.227271  0.688412  0.316644  1
  Cu  Cu34  1  0.846261  0.362933  0.284987  1
  Cu  Cu35  1  0.203200  0.358456  0.299777  1
  Cu  Cu36  1  0.179767  0.028332  0.284432  1
  Cu  Cu37  1  0.510296  0.597198  0.356818  1
  Cu  Cu38  1  0.489139  0.267108  0.339851  1
  Cu  Cu39  1  0.463765  0.937473  0.323885  1
  Cu  Cu40  1  0.844755  0.264058  0.356421  1
  Cu  Cu41  1  0.820833  0.933814  0.340088  1
  Cu  Cu42  1  0.177433  0.930565  0.356797  1
  Cu  Cu43  1  0.796703  0.604176  0.323902  1
  Cu  Cu44  1  0.153877  0.600483  0.340111  1
  Cu  Cu45  1  0.201778  0.260707  0.373045  1
  Cu  Cu46  1  0.720856  0.516087  0.346855  1
  Cu  Cu47  1  0.700182  0.185704  0.330105  1
  Cu  Cu48  1  0.745297  0.845951  0.363400  1
  Cu  Cu49  1  0.054995  0.182834  0.346681  1
  Cu  Cu50  1  0.032614  0.852077  0.330156  1
  Cu  Cu51  1  0.388146  0.849310  0.346780  1
  Cu  Cu52  1  0.078340  0.512553  0.363400  1
  Cu  Cu53  1  0.365505  0.518606  0.330158  1
  Cu  Cu54  1  0.412698  0.179284  0.363413  1
  Cu  Cu55  1  0.498274  0.432115  0.348276  1
  Cu  Cu56  1  0.477171  0.102377  0.331652  1
  Cu  Cu57  1  0.522891  0.762320  0.365011  1
  Cu  Cu58  1  0.832697  0.098990  0.348229  1
  Cu  Cu59  1  0.809630  0.769129  0.331660  1
  Cu  Cu60  1  0.165612  0.765549  0.348256  1
  Cu  Cu61  1  0.855692  0.429113  0.365101  1
  Cu  Cu62  1  0.142530  0.435551  0.331612  1
  Cu  Cu63  1  0.189992  0.095752  0.364918  1
  Cu  Cu64  1  0.633108  0.345342  0.366457  1
  Cu  Cu65  1  0.610256  0.015409  0.349830  1
  Cu  Cu66  1  0.586911  0.685337  0.333225  1
  Cu  Cu67  1  0.967337  0.012054  0.366462  1
  Cu  Cu68  1  0.943174  0.682104  0.349837  1
  Cu  Cu69  1  0.300249  0.678675  0.366489  1
  Cu  Cu70  1  0.919339  0.352280  0.333482  1
  Cu  Cu71  1  0.276139  0.348493  0.349614  1
  Cu  Cu72  1  0.253945  0.018736  0.333176  1
  Cu  Cu73  1  0.581788  0.587333  0.406855  1
  Cu  Cu74  1  0.558736  0.257365  0.389949  1
  Cu  Cu75  1  0.534949  0.927308  0.373524  1
  Cu  Cu76  1  0.915760  0.254054  0.406621  1
  Cu  Cu77  1  0.891776  0.924008  0.390133  1
  Cu  Cu78  1  0.248736  0.920681  0.406843  1
  Cu  Cu79  1  0.868059  0.593992  0.373539  1
  Cu  Cu80  1  0.224775  0.590636  0.390154  1
  Cu  Cu81  1  0.272537  0.250751  0.423325  1
  Cu  Cu82  1  0.792441  0.506013  0.396927  1
  Cu  Cu83  1  0.769535  0.176019  0.380092  1
  Cu  Cu84  1  0.816289  0.836022  0.413578  1
  Cu  Cu85  1  0.126520  0.172734  0.396755  1
  Cu  Cu86  1  0.102323  0.842568  0.380200  1
  Cu  Cu87  1  0.459403  0.839303  0.396885  1
  Cu  Cu88  1  0.149401  0.502633  0.413572  1
  Cu  Cu89  1  0.435249  0.509183  0.380222  1
  Cu  Cu90  1  0.483427  0.169375  0.413506  1
  Cu  Cu91  1  0.569838  0.422313  0.398411  1
  Cu  Cu92  1  0.546951  0.092342  0.381691  1
  Cu  Cu93  1  0.593800  0.752366  0.415144  1
  Cu  Cu94  1  0.903981  0.089041  0.398346  1
  Cu  Cu95  1  0.879774  0.759005  0.381719  1
  Cu  Cu96  1  0.236863  0.755655  0.398402  1
  Cu  Cu97  1  0.926976  0.419023  0.415136  1
  Cu  Cu98  1  0.212789  0.425538  0.381653  1
  Cu  Cu99  1  0.260788  0.085745  0.415072  1
  Cu  Cu100  1  0.704506  0.335395  0.416607  1
  Cu  Cu101  1  0.681351  0.005416  0.399968  1
  Cu  Cu102  1  0.657222  0.675340  0.383289  1
  Cu  Cu103  1  0.038172  1.002089  0.416664  1
  Cu  Cu104  1  0.014333  0.672079  0.399989  1
  Cu  Cu105  1  0.371194  0.668729  0.416688  1
  Cu  Cu106  1  0.990549  0.341982  0.383246  1
  Cu  Cu107  1  0.347437  0.338664  0.399847  1
  Cu  Cu108  1  0.324211  0.008715  0.383254  1
  Cu  Cu109  1  0.652847  0.577431  0.456945  1
  Cu  Cu110  1  0.629592  0.247424  0.440082  1
  Cu  Cu111  1  0.605753  0.917393  0.423552  1
  Cu  Cu112  1  0.986525  0.244114  0.456787  1
  Cu  Cu113  1  0.962698  0.914079  0.440228  1
  Cu  Cu114  1  0.319640  0.910770  0.456936  1
  Cu  Cu115  1  0.938905  0.584061  0.423569  1
  Cu  Cu116  1  0.295833  0.580726  0.440238  1
  Cu  Cu117  1  0.343464  0.240807  0.473487  1
  Cu  Cu118  1  0.863556  0.496057  0.447017  1
  Cu  Cu119  1  0.840416  0.166063  0.430188  1
  Cu  Cu120  1  0.887291  0.826094  0.463707  1
  Cu  Cu121  1  0.197290  0.162762  0.446893  1
  Cu  Cu122  1  0.173346  0.832687  0.430300  1
  Cu  Cu123  1  0.530325  0.829395  0.447008  1
  Cu  Cu124  1  0.220554  0.492740  0.463699  1
  Cu  Cu125  1  0.506474  0.499344  0.430316  1
  Cu  Cu126  1  0.554257  0.159437  0.463615  1
  Cu  Cu127  1  0.641040  0.412411  0.448522  1
  Cu  Cu128  1  0.617813  0.082416  0.431795  1
  Cu  Cu129  1  0.664751  0.742452  0.465266  1
  Cu  Cu130  1  0.974710  0.079104  0.448493  1
  Cu  Cu131  1  0.950795  0.749075  0.431843  1
  Cu  Cu132  1  0.307768  0.745752  0.448548  1
  Cu  Cu133  1  0.998107  0.409107  0.465230  1
  Cu  Cu134  1  0.284002  0.415696  0.431792  1
  Cu  Cu135  1  0.331623  0.075798  0.465204  1
  Cu  Cu136  1  0.775617  0.325474  0.466733  1
  Cu  Cu137  1  0.752092  0.995462  0.450106  1
  Cu  Cu138  1  0.728219  0.665430  0.433415  1
  Cu  Cu139  1  0.109002  0.992149  0.466809  1
  Cu  Cu140  1  0.085212  0.662128  0.450125  1
  Cu  Cu141  1  0.442167  0.658807  0.466824  1
  Cu  Cu142  1  0.061607  0.332077  0.433334  1
  Cu  Cu143  1  0.418588  0.328773  0.450008  1
  Cu  Cu144  1  0.395129  0.998780  0.433387  1
  Cu  Cu145  1  0.723854  0.567513  0.507055  1
  Cu  Cu146  1  0.700455  0.237493  0.490212  1
  Cu  Cu147  1  0.676619  0.907461  0.473646  1
  Cu  Cu148  1  0.057430  0.234187  0.506919  1
  Cu  Cu149  1  0.033555  0.904153  0.490345  1
  Cu  Cu150  1  0.390500  0.900841  0.507052  1
  Cu  Cu151  1  0.009877  0.574126  0.473654  1
  Cu  Cu152  1  0.366847  0.570814  0.490347  1
  Cu  Cu153  1  0.414376  0.230878  0.523610  1
  Cu  Cu154  1  0.934647  0.486141  0.497124  1
  Cu  Cu155  1  0.911185  0.156125  0.480317  1
  Cu  Cu156  1  0.958229  0.816172  0.513831  1
  Cu  Cu157  1  0.268104  0.152816  0.497022  1
  Cu  Cu158  1  0.244280  0.822780  0.480418  1
  Cu  Cu159  1  0.601265  0.819478  0.497131  1
  Cu  Cu160  1  0.291647  0.482837  0.513815  1
  Cu  Cu161  1  0.577602  0.489444  0.480417  1
  Cu  Cu162  1  0.625062  0.149499  0.513740  1
  Cu  Cu163  1  0.712149  0.402502  0.498630  1
  Cu  Cu164  1  0.688571  0.072479  0.481921  1
  Cu  Cu165  1  0.735680  0.732537  0.515389  1
  Cu  Cu166  1  0.045489  0.069169  0.498628  1
  Cu  Cu167  1  0.021721  0.739148  0.481970  1
  Cu  Cu168  1  0.378701  0.735834  0.498674  1
  Cu  Cu169  1  0.069189  0.399201  0.515342  1
  Cu  Cu170  1  0.355109  0.405801  0.481916  1
  Cu  Cu171  1  0.402408  0.065858  0.515333  1
  Cu  Cu172  1  0.846692  0.315560  0.516845  1
  Cu  Cu173  1  0.822874  0.985521  0.500235  1
  Cu  Cu174  1  0.799155  0.655505  0.483538  1
  Cu  Cu175  1  0.179788  0.982211  0.516943  1
  Cu  Cu176  1  0.156140  0.652191  0.500246  1
  Cu  Cu177  1  0.513114  0.648881  0.516946  1
  Cu  Cu178  1  0.132664  0.322166  0.483446  1
  Cu  Cu179  1  0.489653  0.318863  0.500136  1
  Cu  Cu180  1  0.465927  0.988837  0.483519  1
  Cu  Cu181  1  0.794812  0.557597  0.557179  1
  Cu  Cu182  1  0.771389  0.227569  0.540324  1
  Cu  Cu183  1  0.747469  0.897530  0.523775  1
  Cu  Cu184  1  0.128381  0.224276  0.557030  1
  Cu  Cu185  1  0.104393  0.894219  0.540479  1
  Cu  Cu186  1  0.461307  0.890911  0.557184  1
  Cu  Cu187  1  0.080855  0.564199  0.523772  1
  Cu  Cu188  1  0.437828  0.560891  0.540475  1
  Cu  Cu189  1  0.485295  0.220949  0.573695  1
  Cu  Cu190  1  0.005738  0.476233  0.547249  1
  Cu  Cu191  1  0.982000  0.146192  0.530450  1
  Cu  Cu192  1  0.029186  0.806248  0.563950  1
  Cu  Cu193  1  0.338912  0.142877  0.547149  1
  Cu  Cu194  1  0.315227  0.812858  0.530541  1
  Cu  Cu195  1  0.672216  0.809566  0.547266  1
  Cu  Cu196  1  0.362733  0.472932  0.563925  1
  Cu  Cu197  1  0.648707  0.479534  0.530528  1
  Cu  Cu198  1  0.695890  0.139562  0.563870  1
  Cu  Cu199  1  0.783258  0.392597  0.548737  1
  Cu  Cu200  1  0.759356  0.062541  0.532051  1
  Cu  Cu201  1  0.806625  0.722638  0.565511  1
  Cu  Cu202  1  0.116269  0.059237  0.548762  1
  Cu  Cu203  1  0.092662  0.729219  0.532089  1
  Cu  Cu204  1  0.449660  0.725912  0.548790  1
  Cu  Cu205  1  0.140298  0.389313  0.565464  1
  Cu  Cu206  1  0.426192  0.395899  0.532027  1
  Cu  Cu207  1  0.473169  0.055925  0.565458  1
  Cu  Cu208  1  0.917799  0.305662  0.566946  1
  Cu  Cu209  1  0.893669  0.975579  0.550365  1
  Cu  Cu210  1  0.870093  0.645587  0.533656  1
  Cu  Cu211  1  0.250541  0.972276  0.567070  1
  Cu  Cu212  1  0.227085  0.642250  0.550359  1
  Cu  Cu213  1  0.584056  0.638952  0.567058  1
  Cu  Cu214  1  0.203731  0.312263  0.533563  1
  Cu  Cu215  1  0.560721  0.308950  0.550244  1
  Cu  Cu216  1  0.536709  0.978899  0.533644  1
  Cu  Cu217  1  0.865752  0.547685  0.607300  1
  Cu  Cu218  1  0.842396  0.217668  0.590412  1
  Cu  Cu219  1  0.818353  0.887592  0.573937  1
  Cu  Cu220  1  0.199387  0.214375  0.607112  1
  Cu  Cu221  1  0.175117  0.884281  0.590644  1
  Cu  Cu222  1  0.532126  0.880980  0.607314  1
  Cu  Cu223  1  0.151837  0.554258  0.573926  1
  Cu  Cu224  1  0.508698  0.550961  0.590636  1
  Cu  Cu225  1  0.556118  0.211042  0.623718  1
  Cu  Cu226  1  0.076910  0.466354  0.597408  1
  Cu  Cu227  1  0.052865  0.136264  0.580590  1
  Cu  Cu228  1  0.100204  0.796338  0.614043  1
  Cu  Cu229  1  0.409676  0.132934  0.597283  1
  Cu  Cu230  1  0.386242  0.802931  0.580671  1
  Cu  Cu231  1  0.743266  0.799683  0.597426  1
  Cu  Cu232  1  0.433808  0.463046  0.614010  1
  Cu  Cu233  1  0.719853  0.469625  0.580650  1
  Cu  Cu234  1  0.766828  0.129646  0.614000  1
  Cu  Cu235  1  0.854465  0.382706  0.598845  1
  Cu  Cu236  1  0.830194  0.052605  0.582182  1
  Cu  Cu237  1  0.877690  0.712818  0.615631  1
  Cu  Cu238  1  0.187006  0.049310  0.598907  1
  Cu  Cu239  1  0.163684  0.719281  0.582192  1
  Cu  Cu240  1  0.520698  0.715986  0.598900  1
  Cu  Cu241  1  0.211508  0.379489  0.615603  1
  Cu  Cu242  1  0.497323  0.385994  0.582121  1
  Cu  Cu243  1  0.544031  0.046018  0.615562  1
  Cu  Cu244  1  0.989004  0.295837  0.617038  1
  Cu  Cu245  1  0.964436  0.965622  0.600500  1
  Cu  Cu246  1  0.941054  0.635693  0.583761  1
  Cu  Cu247  1  0.321406  0.962335  0.617164  1
  Cu  Cu248  1  0.298039  0.632244  0.600462  1
  Cu  Cu249  1  0.655110  0.629053  0.617145  1
  Cu  Cu250  1  0.274865  0.302379  0.583689  1
  Cu  Cu251  1  0.631828  0.299009  0.600331  1
  Cu  Cu252  1  0.607524  0.968971  0.583752  1
  Cu  Cu253  1  0.935287  0.537952  0.657387  1
  Cu  Cu254  1  0.913833  0.207815  0.640443  1
  Cu  Cu255  1  0.889108  0.877663  0.624210  1
  Cu  Cu256  1  0.270255  0.204574  0.657145  1
  Cu  Cu257  1  0.246087  0.874292  0.640837  1
  Cu  Cu258  1  0.601727  0.871287  0.657400  1
  Cu  Cu259  1  0.222621  0.544311  0.624205  1
  Cu  Cu260  1  0.579830  0.540992  0.640825  1
  Cu  Cu261  1  0.627422  0.200895  0.673354  1
  Cu  Cu262  1  0.148219  0.456551  0.647641  1
  Cu  Cu263  1  0.123724  0.126315  0.630784  1
  Cu  Cu264  1  0.171438  0.786052  0.663814  1
  Cu  Cu265  1  0.480785  0.122963  0.647421  1
  Cu  Cu266  1  0.457579  0.792983  0.630818  1
  Cu  Cu267  1  0.814553  0.789908  0.647646  1
  Cu  Cu268  1  0.505034  0.452781  0.663767  1
  Cu  Cu269  1  0.791268  0.459697  0.630793  1
  Cu  Cu270  1  0.837136  0.119655  0.664071  1
  Cu  Cu271  1  0.926026  0.372936  0.648978  1
  Cu  Cu272  1  0.900999  0.042619  0.632334  1
  Cu  Cu273  1  0.947652  0.702929  0.665652  1
  Cu  Cu274  1  0.258289  0.039394  0.649022  1
  Cu  Cu275  1  0.234880  0.709160  0.632249  1
  Cu  Cu276  1  0.592315  0.706162  0.649005  1
  Cu  Cu277  1  0.281790  0.369506  0.665643  1
  Cu  Cu278  1  0.568614  0.375925  0.632154  1
  Cu  Cu279  1  0.613837  0.036020  0.665602  1
  Cu  Cu280  1  0.058744  0.286461  0.667095  1
  Cu  Cu281  1  0.035953  0.955549  0.650574  1
  Cu  Cu282  1  0.011848  0.625823  0.633841  1
  Cu  Cu283  1  0.390759  0.952703  0.667146  1
  Cu  Cu284  1  0.369855  0.622111  0.650504  1
  Cu  Cu285  1  0.724507  0.619507  0.667142  1
  Cu  Cu286  1  0.345925  0.292487  0.633857  1
  Cu  Cu287  1  0.703398  0.288962  0.650402  1
  Cu  Cu288  1  0.678256  0.959092  0.633841  1
  Cu  Cu289  1  0.007063  0.527967  0.706306  1
  Cu  Cu290  1  0.985423  0.198246  0.689940  1
  Cu  Cu291  1  0.961241  0.867407  0.674292  1
  Cu  Cu292  1  0.341553  0.194286  0.706754  1
  Cu  Cu293  1  0.314419  0.864520  0.690778  1
  Cu  Cu294  1  0.673359  0.861322  0.706319  1
  Cu  Cu295  1  0.294927  0.534037  0.674293  1
  Cu  Cu296  1  0.648059  0.531172  0.690772  1
  Cu  Cu297  1  0.702319  0.191414  0.721438  1
  Cu  Cu298  1  0.221132  0.446608  0.697476  1
  Cu  Cu299  1  0.196829  0.116646  0.680603  1
  Cu  Cu300  1  0.245036  0.775669  0.712286  1
  Cu  Cu301  1  0.552031  0.112805  0.697359  1
  Cu  Cu302  1  0.530632  0.783385  0.680611  1
  Cu  Cu303  1  0.887459  0.780059  0.697498  1
  Cu  Cu304  1  0.578069  0.442179  0.712258  1
  Cu  Cu305  1  0.864109  0.450064  0.680612  1
  Cu  Cu306  1  0.911283  0.110113  0.712812  1
  Cu  Cu307  1  0.995258  0.363706  0.699041  1
  Cu  Cu308  1  0.973541  0.032752  0.681951  1
  Cu  Cu309  1  0.024326  0.692215  0.713926  1
  Cu  Cu310  1  0.327161  0.029937  0.699033  1
  Cu  Cu311  1  0.307793  0.699106  0.681768  1
  Cu  Cu312  1  0.661357  0.696978  0.699034  1
  Cu  Cu313  1  0.357069  0.358377  0.713958  1
  Cu  Cu314  1  0.640647  0.365889  0.681686  1
  Cu  Cu315  1  0.690573  0.025884  0.714055  1
  Cu  Cu316  1  0.130834  0.275581  0.715510  1
  Cu  Cu317  1  0.103476  0.946036  0.700427  1
  Cu  Cu318  1  0.083958  0.615544  0.683240  1
  Cu  Cu319  1  0.467639  0.943087  0.715206  1
  Cu  Cu320  1  0.437391  0.612763  0.700398  1
  Cu  Cu321  1  0.801144  0.609770  0.715163  1
  Cu  Cu322  1  0.417377  0.281593  0.683628  1
  Cu  Cu323  1  0.770532  0.280100  0.700397  1
  Cu  Cu324  1  0.750216  0.948972  0.683312  1
