# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.05865338
_cell_length_b   17.35006099
_cell_length_c   46.62234189
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   76.38717102
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu
_chemical_formula_sum   Cu336
_cell_volume   8694.06012012
_cell_formula_units_Z   336
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  0.087639  0.358863  0.285860  1
  Cu  Cu2  1  0.483104  0.366091  0.275920  1
  Cu  Cu3  1  0.696873  0.353763  0.295235  1
  Cu  Cu4  1  0.087639  0.858863  0.285860  1
  Cu  Cu5  1  0.483104  0.866091  0.275920  1
  Cu  Cu6  1  0.696873  0.853763  0.295235  1
  Cu  Cu7  1  0.303399  0.482618  0.286346  1
  Cu  Cu8  1  0.692954  0.490140  0.276604  1
  Cu  Cu9  1  0.909432  0.477552  0.295826  1
  Cu  Cu10  1  0.303399  0.982618  0.286346  1
  Cu  Cu11  1  0.692954  0.990140  0.276604  1
  Cu  Cu12  1  0.909432  0.977552  0.295826  1
  Cu  Cu13  1  0.999820  0.599549  0.299966  1
  Cu  Cu14  1  0.392803  0.605210  0.290441  1
  Cu  Cu15  1  0.780741  0.612826  0.280447  1
  Cu  Cu16  1  0.999820  0.099549  0.299966  1
  Cu  Cu17  1  0.392803  0.105210  0.290441  1
  Cu  Cu18  1  0.780741  0.112826  0.280447  1
  Cu  Cu19  1  0.089274  0.722568  0.304248  1
  Cu  Cu20  1  0.482061  0.728770  0.293965  1
  Cu  Cu21  1  0.871756  0.734305  0.284473  1
  Cu  Cu22  1  0.089274  0.222568  0.304248  1
  Cu  Cu23  1  0.482061  0.228770  0.293965  1
  Cu  Cu24  1  0.871756  0.234305  0.284473  1
  Cu  Cu25  1  0.909745  0.342777  0.316309  1
  Cu  Cu26  1  0.302698  0.346662  0.305543  1
  Cu  Cu27  1  0.516819  0.337596  0.327743  1
  Cu  Cu28  1  0.909745  0.842777  0.316309  1
  Cu  Cu29  1  0.302698  0.846662  0.305543  1
  Cu  Cu30  1  0.516819  0.837596  0.327743  1
  Cu  Cu31  1  0.124671  0.466836  0.317439  1
  Cu  Cu32  1  0.517292  0.473266  0.307538  1
  Cu  Cu33  1  0.732840  0.462185  0.328663  1
  Cu  Cu34  1  0.124671  0.966836  0.317439  1
  Cu  Cu35  1  0.517292  0.973266  0.307538  1
  Cu  Cu36  1  0.732840  0.962185  0.328663  1
  Cu  Cu37  1  0.820997  0.584745  0.332433  1
  Cu  Cu38  1  0.213337  0.589792  0.321711  1
  Cu  Cu39  1  0.604731  0.596291  0.311764  1
  Cu  Cu40  1  0.820997  0.084745  0.332433  1
  Cu  Cu41  1  0.213337  0.089792  0.321711  1
  Cu  Cu42  1  0.604731  0.096291  0.311764  1
  Cu  Cu43  1  0.909530  0.706975  0.336597  1
  Cu  Cu44  1  0.301949  0.713026  0.325586  1
  Cu  Cu45  1  0.692953  0.719686  0.315456  1
  Cu  Cu46  1  0.909530  0.206975  0.336597  1
  Cu  Cu47  1  0.301949  0.213026  0.325586  1
  Cu  Cu48  1  0.692953  0.219686  0.315456  1
  Cu  Cu49  1  0.731934  0.326703  0.348620  1
  Cu  Cu50  1  0.124076  0.331432  0.338156  1
  Cu  Cu51  1  0.338013  0.321119  0.359329  1
  Cu  Cu52  1  0.731934  0.826703  0.348620  1
  Cu  Cu53  1  0.124076  0.831432  0.338156  1
  Cu  Cu54  1  0.338013  0.821119  0.359329  1
  Cu  Cu55  1  0.947259  0.450925  0.349430  1
  Cu  Cu56  1  0.339306  0.455905  0.338923  1
  Cu  Cu57  1  0.554310  0.445954  0.360675  1
  Cu  Cu58  1  0.947259  0.950925  0.349430  1
  Cu  Cu59  1  0.339306  0.955905  0.338923  1
  Cu  Cu60  1  0.554310  0.945954  0.360675  1
  Cu  Cu61  1  0.641783  0.568884  0.364935  1
  Cu  Cu62  1  0.034935  0.573801  0.353748  1
  Cu  Cu63  1  0.426485  0.579536  0.343568  1
  Cu  Cu64  1  0.641783  0.068884  0.364935  1
  Cu  Cu65  1  0.034935  0.073801  0.353748  1
  Cu  Cu66  1  0.426485  0.079536  0.343568  1
  Cu  Cu67  1  0.729924  0.691513  0.368939  1
  Cu  Cu68  1  0.123133  0.696545  0.358049  1
  Cu  Cu69  1  0.514640  0.702524  0.347641  1
  Cu  Cu70  1  0.729924  0.191513  0.368939  1
  Cu  Cu71  1  0.123133  0.196545  0.358049  1
  Cu  Cu72  1  0.514640  0.202524  0.347641  1
  Cu  Cu73  1  0.553083  0.310488  0.381100  1
  Cu  Cu74  1  0.945750  0.315658  0.370039  1
  Cu  Cu75  1  0.159952  0.304992  0.391786  1
  Cu  Cu76  1  0.553083  0.810488  0.381100  1
  Cu  Cu77  1  0.945750  0.815658  0.370039  1
  Cu  Cu78  1  0.159952  0.804992  0.391786  1
  Cu  Cu79  1  0.769061  0.434932  0.382130  1
  Cu  Cu80  1  0.161177  0.440288  0.371123  1
  Cu  Cu81  1  0.375752  0.429581  0.392767  1
  Cu  Cu82  1  0.769061  0.934932  0.382130  1
  Cu  Cu83  1  0.161177  0.940288  0.371123  1
  Cu  Cu84  1  0.375752  0.929581  0.392767  1
  Cu  Cu85  1  0.463287  0.552615  0.397263  1
  Cu  Cu86  1  0.856647  0.557746  0.386228  1
  Cu  Cu87  1  0.248778  0.563063  0.375497  1
  Cu  Cu88  1  0.463287  0.052615  0.397263  1
  Cu  Cu89  1  0.856647  0.057746  0.386228  1
  Cu  Cu90  1  0.248778  0.063063  0.375497  1
  Cu  Cu91  1  0.551315  0.675394  0.401503  1
  Cu  Cu92  1  0.944530  0.680552  0.390530  1
  Cu  Cu93  1  0.336543  0.686202  0.379798  1
  Cu  Cu94  1  0.551315  0.175394  0.401503  1
  Cu  Cu95  1  0.944530  0.180552  0.390530  1
  Cu  Cu96  1  0.336543  0.186202  0.379798  1
  Cu  Cu97  1  0.374434  0.294406  0.413300  1
  Cu  Cu98  1  0.767485  0.299682  0.402528  1
  Cu  Cu99  1  0.981681  0.288966  0.424067  1
  Cu  Cu100  1  0.374434  0.794406  0.413300  1
  Cu  Cu101  1  0.767485  0.799682  0.402528  1
  Cu  Cu102  1  0.981681  0.788966  0.424067  1
  Cu  Cu103  1  0.590395  0.418932  0.414443  1
  Cu  Cu104  1  0.983174  0.424134  0.403494  1
  Cu  Cu105  1  0.197471  0.413525  0.425104  1
  Cu  Cu106  1  0.590395  0.918932  0.414443  1
  Cu  Cu107  1  0.983174  0.924134  0.403494  1
  Cu  Cu108  1  0.197471  0.913525  0.425104  1
  Cu  Cu109  1  0.285152  0.536368  0.429488  1
  Cu  Cu110  1  0.678132  0.541757  0.418739  1
  Cu  Cu111  1  0.070781  0.547038  0.407834  1
  Cu  Cu112  1  0.285152  0.036368  0.429488  1
  Cu  Cu113  1  0.678132  0.041757  0.418739  1
  Cu  Cu114  1  0.070781  0.047038  0.407834  1
  Cu  Cu115  1  0.372976  0.659293  0.433849  1
  Cu  Cu116  1  0.766009  0.664533  0.422957  1
  Cu  Cu117  1  0.158657  0.669857  0.412191  1
  Cu  Cu118  1  0.372976  0.159293  0.433849  1
  Cu  Cu119  1  0.766009  0.164533  0.422957  1
  Cu  Cu120  1  0.158657  0.169857  0.412191  1
  Cu  Cu121  1  0.196115  0.278300  0.445675  1
  Cu  Cu122  1  0.589036  0.283663  0.434939  1
  Cu  Cu123  1  0.803442  0.272889  0.456470  1
  Cu  Cu124  1  0.196115  0.778300  0.445675  1
  Cu  Cu125  1  0.589036  0.783663  0.434939  1
  Cu  Cu126  1  0.803442  0.772889  0.456470  1
  Cu  Cu127  1  0.411960  0.402820  0.446703  1
  Cu  Cu128  1  0.804889  0.408101  0.435972  1
  Cu  Cu129  1  0.019246  0.397405  0.457478  1
  Cu  Cu130  1  0.411960  0.902820  0.446703  1
  Cu  Cu131  1  0.804889  0.908101  0.435972  1
  Cu  Cu132  1  0.019246  0.897405  0.457478  1
  Cu  Cu133  1  0.106953  0.520280  0.461822  1
  Cu  Cu134  1  0.499714  0.525697  0.451112  1
  Cu  Cu135  1  0.892598  0.530956  0.440223  1
  Cu  Cu136  1  0.106953  0.020280  0.461822  1
  Cu  Cu137  1  0.499714  0.025697  0.451112  1
  Cu  Cu138  1  0.892598  0.030956  0.440223  1
  Cu  Cu139  1  0.194772  0.643117  0.466192  1
  Cu  Cu140  1  0.587619  0.648491  0.455424  1
  Cu  Cu141  1  0.980379  0.653807  0.444568  1
  Cu  Cu142  1  0.194772  0.143117  0.466192  1
  Cu  Cu143  1  0.587619  0.148491  0.455424  1
  Cu  Cu144  1  0.980379  0.153807  0.444568  1
  Cu  Cu145  1  0.017846  0.262207  0.478033  1
  Cu  Cu146  1  0.410635  0.267615  0.467253  1
  Cu  Cu147  1  0.625149  0.256861  0.488851  1
  Cu  Cu148  1  0.017846  0.762207  0.478033  1
  Cu  Cu149  1  0.410635  0.767615  0.467253  1
  Cu  Cu150  1  0.625149  0.756861  0.488851  1
  Cu  Cu151  1  0.233658  0.386731  0.479056  1
  Cu  Cu152  1  0.626484  0.392083  0.468320  1
  Cu  Cu153  1  0.840974  0.381310  0.489878  1
  Cu  Cu154  1  0.233658  0.886731  0.479056  1
  Cu  Cu155  1  0.626484  0.892083  0.468320  1
  Cu  Cu156  1  0.840974  0.881310  0.489878  1
  Cu  Cu157  1  0.928751  0.504170  0.494196  1
  Cu  Cu158  1  0.321438  0.509573  0.483422  1
  Cu  Cu159  1  0.714299  0.514906  0.472647  1
  Cu  Cu160  1  0.928751  0.004170  0.494196  1
  Cu  Cu161  1  0.321438  0.009573  0.483422  1
  Cu  Cu162  1  0.714299  0.014906  0.472647  1
  Cu  Cu163  1  0.016519  0.627027  0.498552  1
  Cu  Cu164  1  0.409271  0.632431  0.487798  1
  Cu  Cu165  1  0.802113  0.637722  0.476963  1
  Cu  Cu166  1  0.016519  0.127027  0.498552  1
  Cu  Cu167  1  0.409271  0.132431  0.487798  1
  Cu  Cu168  1  0.802113  0.137722  0.476963  1
  Cu  Cu169  1  0.839604  0.246105  0.510423  1
  Cu  Cu170  1  0.232315  0.251519  0.499608  1
  Cu  Cu171  1  0.446839  0.240807  0.521200  1
  Cu  Cu172  1  0.839604  0.746105  0.510423  1
  Cu  Cu173  1  0.232315  0.751519  0.499608  1
  Cu  Cu174  1  0.446839  0.740807  0.521200  1
  Cu  Cu175  1  0.055406  0.370607  0.511444  1
  Cu  Cu176  1  0.448147  0.376011  0.500642  1
  Cu  Cu177  1  0.662632  0.365287  0.522241  1
  Cu  Cu178  1  0.055406  0.870607  0.511444  1
  Cu  Cu179  1  0.448147  0.876011  0.500642  1
  Cu  Cu180  1  0.662632  0.865287  0.522241  1
  Cu  Cu181  1  0.750494  0.488094  0.526572  1
  Cu  Cu182  1  0.143181  0.493476  0.515771  1
  Cu  Cu183  1  0.535964  0.498864  0.505016  1
  Cu  Cu184  1  0.750494  0.988094  0.526572  1
  Cu  Cu185  1  0.143181  0.993476  0.515771  1
  Cu  Cu186  1  0.535964  0.998864  0.505016  1
  Cu  Cu187  1  0.838293  0.610924  0.530940  1
  Cu  Cu188  1  0.230980  0.616318  0.520136  1
  Cu  Cu189  1  0.623815  0.621675  0.509363  1
  Cu  Cu190  1  0.838293  0.110924  0.530940  1
  Cu  Cu191  1  0.230980  0.116318  0.520136  1
  Cu  Cu192  1  0.623815  0.121675  0.509363  1
  Cu  Cu193  1  0.661335  0.230089  0.542785  1
  Cu  Cu194  1  0.054030  0.235411  0.532004  1
  Cu  Cu195  1  0.268496  0.224721  0.553541  1
  Cu  Cu196  1  0.661335  0.730089  0.542785  1
  Cu  Cu197  1  0.054030  0.735411  0.532004  1
  Cu  Cu198  1  0.268496  0.724721  0.553541  1
  Cu  Cu199  1  0.877127  0.354490  0.543814  1
  Cu  Cu200  1  0.269854  0.359914  0.533006  1
  Cu  Cu201  1  0.484316  0.349212  0.554591  1
  Cu  Cu202  1  0.877127  0.854490  0.543814  1
  Cu  Cu203  1  0.269854  0.859914  0.533006  1
  Cu  Cu204  1  0.484316  0.849212  0.554591  1
  Cu  Cu205  1  0.572154  0.472100  0.558942  1
  Cu  Cu206  1  0.964963  0.477359  0.548153  1
  Cu  Cu207  1  0.357691  0.482766  0.537346  1
  Cu  Cu208  1  0.572154  0.972100  0.558942  1
  Cu  Cu209  1  0.964963  0.977359  0.548153  1
  Cu  Cu210  1  0.357691  0.982766  0.537346  1
  Cu  Cu211  1  0.660009  0.594902  0.563283  1
  Cu  Cu212  1  0.052688  0.600234  0.552495  1
  Cu  Cu213  1  0.445487  0.605633  0.541735  1
  Cu  Cu214  1  0.660009  0.094902  0.563283  1
  Cu  Cu215  1  0.052688  0.100234  0.552495  1
  Cu  Cu216  1  0.445487  0.105633  0.541735  1
  Cu  Cu217  1  0.483074  0.214031  0.575158  1
  Cu  Cu218  1  0.875757  0.219275  0.564409  1
  Cu  Cu219  1  0.090149  0.208607  0.585997  1
  Cu  Cu220  1  0.483074  0.714031  0.575158  1
  Cu  Cu221  1  0.875757  0.719275  0.564409  1
  Cu  Cu222  1  0.090149  0.708607  0.585997  1
  Cu  Cu223  1  0.698693  0.338527  0.576192  1
  Cu  Cu224  1  0.091638  0.343764  0.565427  1
  Cu  Cu225  1  0.306031  0.333082  0.586971  1
  Cu  Cu226  1  0.698693  0.838527  0.576192  1
  Cu  Cu227  1  0.091638  0.843764  0.565427  1
  Cu  Cu228  1  0.306031  0.833082  0.586971  1
  Cu  Cu229  1  0.393951  0.455980  0.591271  1
  Cu  Cu230  1  0.786677  0.461269  0.580486  1
  Cu  Cu231  1  0.179452  0.466653  0.569695  1
  Cu  Cu232  1  0.393951  0.955980  0.591271  1
  Cu  Cu233  1  0.786677  0.961269  0.580486  1
  Cu  Cu234  1  0.179452  0.966653  0.569695  1
  Cu  Cu235  1  0.481659  0.578945  0.595679  1
  Cu  Cu236  1  0.874460  0.584123  0.584919  1
  Cu  Cu237  1  0.267166  0.589525  0.574051  1
  Cu  Cu238  1  0.481659  0.078945  0.595679  1
  Cu  Cu239  1  0.874460  0.084123  0.584919  1
  Cu  Cu240  1  0.267166  0.089525  0.574051  1
  Cu  Cu241  1  0.304634  0.197988  0.607430  1
  Cu  Cu242  1  0.697424  0.203343  0.596742  1
  Cu  Cu243  1  0.911824  0.192370  0.618494  1
  Cu  Cu244  1  0.304634  0.697988  0.607430  1
  Cu  Cu245  1  0.697424  0.703343  0.596742  1
  Cu  Cu246  1  0.911824  0.692370  0.618494  1
  Cu  Cu247  1  0.520201  0.322469  0.608583  1
  Cu  Cu248  1  0.913359  0.327575  0.597738  1
  Cu  Cu249  1  0.128019  0.316868  0.619496  1
  Cu  Cu250  1  0.520201  0.822469  0.608583  1
  Cu  Cu251  1  0.913359  0.827575  0.597738  1
  Cu  Cu252  1  0.128019  0.816868  0.619496  1
  Cu  Cu253  1  0.215982  0.439712  0.623591  1
  Cu  Cu254  1  0.608113  0.445419  0.612886  1
  Cu  Cu255  1  1.001268  0.450517  0.602085  1
  Cu  Cu256  1  0.215982  0.939712  0.623591  1
  Cu  Cu257  1  0.608113  0.945419  0.612886  1
  Cu  Cu258  1  1.001268  0.950517  0.602085  1
  Cu  Cu259  1  0.303512  0.562709  0.627920  1
  Cu  Cu260  1  0.696058  0.568163  0.617149  1
  Cu  Cu261  1  0.088801  0.573434  0.606381  1
  Cu  Cu262  1  0.303512  0.062709  0.627920  1
  Cu  Cu263  1  0.696058  0.068163  0.617149  1
  Cu  Cu264  1  0.088801  0.073434  0.606381  1
  Cu  Cu265  1  0.126372  0.181701  0.639976  1
  Cu  Cu266  1  0.519218  0.187315  0.629205  1
  Cu  Cu267  1  0.733260  0.176523  0.650690  1
  Cu  Cu268  1  0.126372  0.681701  0.639976  1
  Cu  Cu269  1  0.519218  0.687315  0.629205  1
  Cu  Cu270  1  0.733260  0.676523  0.650690  1
  Cu  Cu271  1  0.341847  0.306179  0.641043  1
  Cu  Cu272  1  0.734583  0.311740  0.630122  1
  Cu  Cu273  1  0.949969  0.300598  0.651533  1
  Cu  Cu274  1  0.341847  0.806179  0.641043  1
  Cu  Cu275  1  0.734583  0.811740  0.630122  1
  Cu  Cu276  1  0.949969  0.800598  0.651533  1
  Cu  Cu277  1  0.037773  0.423907  0.655873  1
  Cu  Cu278  1  0.429934  0.429189  0.645286  1
  Cu  Cu279  1  0.822938  0.434254  0.634311  1
  Cu  Cu280  1  0.037773  0.923907  0.655873  1
  Cu  Cu281  1  0.429934  0.929189  0.645286  1
  Cu  Cu282  1  0.822938  0.934254  0.634311  1
  Cu  Cu283  1  0.125610  0.546594  0.659910  1
  Cu  Cu284  1  0.517563  0.552265  0.649664  1
  Cu  Cu285  1  0.910673  0.557260  0.638936  1
  Cu  Cu286  1  0.125610  0.046594  0.659910  1
  Cu  Cu287  1  0.517563  0.052265  0.649664  1
  Cu  Cu288  1  0.910673  0.057260  0.638936  1
  Cu  Cu289  1  0.948746  0.165114  0.672378  1
  Cu  Cu290  1  0.340468  0.171367  0.661033  1
  Cu  Cu291  1  0.555923  0.159944  0.682991  1
  Cu  Cu292  1  0.948746  0.665114  0.672378  1
  Cu  Cu293  1  0.340468  0.671367  0.661033  1
  Cu  Cu294  1  0.555923  0.659944  0.682991  1
  Cu  Cu295  1  0.163147  0.289482  0.673524  1
  Cu  Cu296  1  0.555058  0.296079  0.662504  1
  Cu  Cu297  1  0.770967  0.284361  0.683341  1
  Cu  Cu298  1  0.163147  0.789482  0.673524  1
  Cu  Cu299  1  0.555058  0.796079  0.662504  1
  Cu  Cu300  1  0.770967  0.784361  0.683341  1
  Cu  Cu301  1  0.860109  0.407504  0.687518  1
  Cu  Cu302  1  0.251801  0.412576  0.677198  1
  Cu  Cu303  1  0.643532  0.418715  0.666667  1
  Cu  Cu304  1  0.860109  0.907504  0.687518  1
  Cu  Cu305  1  0.251801  0.912576  0.677198  1
  Cu  Cu306  1  0.643532  0.918715  0.666667  1
  Cu  Cu307  1  0.948192  0.531183  0.692603  1
  Cu  Cu308  1  0.339784  0.536048  0.681423  1
  Cu  Cu309  1  0.732302  0.541148  0.670566  1
  Cu  Cu310  1  0.948192  0.031183  0.692603  1
  Cu  Cu311  1  0.339784  0.036048  0.681423  1
  Cu  Cu312  1  0.732302  0.041148  0.670566  1
  Cu  Cu313  1  0.770016  0.149604  0.703933  1
  Cu  Cu314  1  0.160980  0.155620  0.693644  1
  Cu  Cu315  1  0.376418  0.144032  0.713140  1
  Cu  Cu316  1  0.770016  0.649604  0.703933  1
  Cu  Cu317  1  0.160980  0.655620  0.693644  1
  Cu  Cu318  1  0.376418  0.644032  0.713140  1
  Cu  Cu319  1  0.982571  0.274708  0.704708  1
  Cu  Cu320  1  0.375660  0.280089  0.694878  1
  Cu  Cu321  1  0.593259  0.268472  0.714545  1
  Cu  Cu322  1  0.982571  0.774708  0.704708  1
  Cu  Cu323  1  0.375660  0.780089  0.694878  1
  Cu  Cu324  1  0.593259  0.768472  0.714545  1
  Cu  Cu325  1  0.682997  0.390078  0.718597  1
  Cu  Cu326  1  0.072872  0.397125  0.708594  1
  Cu  Cu327  1  0.464249  0.403266  0.699108  1
  Cu  Cu328  1  0.682997  0.890078  0.718597  1
  Cu  Cu329  1  0.072872  0.897125  0.708594  1
  Cu  Cu330  1  0.464249  0.903266  0.699108  1
  Cu  Cu331  1  0.767220  0.513048  0.722311  1
  Cu  Cu332  1  0.162918  0.519311  0.712168  1
  Cu  Cu333  1  0.553362  0.525355  0.703133  1
  Cu  Cu334  1  0.767220  0.013048  0.722311  1
  Cu  Cu335  1  0.162918  0.019311  0.712168  1
  Cu  Cu336  1  0.553362  0.025355  0.703133  1
