# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   13.20449315
_cell_length_b   11.15330889
_cell_length_c   46.68103466
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   126.15272640
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu
_chemical_formula_sum   Cu216
_cell_volume   5551.11397438
_cell_formula_units_Z   216
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  0.071620  0.925544  0.292849  1
  Cu  Cu2  1  0.738287  0.925544  0.292849  1
  Cu  Cu3  1  0.675332  0.457196  0.281997  1
  Cu  Cu4  1  0.404953  0.925544  0.292849  1
  Cu  Cu5  1  0.341999  0.457196  0.281997  1
  Cu  Cu6  1  0.008666  0.457196  0.281997  1
  Cu  Cu7  1  0.485714  0.190229  0.287570  1
  Cu  Cu8  1  0.152381  0.190229  0.287570  1
  Cu  Cu9  1  0.092276  0.727295  0.277143  1
  Cu  Cu10  1  0.819048  0.190229  0.287570  1
  Cu  Cu11  1  0.758943  0.727295  0.277143  1
  Cu  Cu12  1  0.425609  0.727295  0.277143  1
  Cu  Cu13  1  0.881247  0.869312  0.319024  1
  Cu  Cu14  1  0.547914  0.869312  0.319024  1
  Cu  Cu15  1  0.477200  0.395424  0.305335  1
  Cu  Cu16  1  0.214580  0.869312  0.319024  1
  Cu  Cu17  1  0.143867  0.395424  0.305335  1
  Cu  Cu18  1  0.810533  0.395424  0.305335  1
  Cu  Cu19  1  0.290094  0.129213  0.310819  1
  Cu  Cu20  1  0.956761  0.129213  0.310819  1
  Cu  Cu21  1  0.891397  0.659427  0.299474  1
  Cu  Cu22  1  0.623427  0.129213  0.310819  1
  Cu  Cu23  1  0.558064  0.659427  0.299474  1
  Cu  Cu24  1  0.224730  0.659427  0.299474  1
  Cu  Cu25  1  0.683880  0.807117  0.343338  1
  Cu  Cu26  1  0.350547  0.807117  0.343338  1
  Cu  Cu27  1  0.281805  0.336140  0.331286  1
  Cu  Cu28  1  0.017214  0.807117  0.343338  1
  Cu  Cu29  1  0.948472  0.336140  0.331286  1
  Cu  Cu30  1  0.615139  0.336140  0.331286  1
  Cu  Cu31  1  0.095670  0.072236  0.337344  1
  Cu  Cu32  1  0.762337  0.072236  0.337344  1
  Cu  Cu33  1  0.694067  0.601766  0.325540  1
  Cu  Cu34  1  0.429004  0.072236  0.337344  1
  Cu  Cu35  1  0.360733  0.601766  0.325540  1
  Cu  Cu36  1  0.027400  0.601766  0.325540  1
  Cu  Cu37  1  0.488212  0.748455  0.368588  1
  Cu  Cu38  1  0.154879  0.748455  0.368588  1
  Cu  Cu39  1  0.085315  0.276829  0.355510  1
  Cu  Cu40  1  0.821545  0.748455  0.368588  1
  Cu  Cu41  1  0.751982  0.276829  0.355510  1
  Cu  Cu42  1  0.418648  0.276829  0.355510  1
  Cu  Cu43  1  0.899049  0.013852  0.362088  1
  Cu  Cu44  1  0.565716  0.013852  0.362088  1
  Cu  Cu45  1  0.497057  0.541902  0.349610  1
  Cu  Cu46  1  0.232382  0.013852  0.362088  1
  Cu  Cu47  1  0.163723  0.541902  0.349610  1
  Cu  Cu48  1  0.830390  0.541902  0.349610  1
  Cu  Cu49  1  0.291440  0.688370  0.393490  1
  Cu  Cu50  1  0.958107  0.688370  0.393490  1
  Cu  Cu51  1  0.889345  0.218156  0.381035  1
  Cu  Cu52  1  0.624773  0.688370  0.393490  1
  Cu  Cu53  1  0.556012  0.218156  0.381035  1
  Cu  Cu54  1  0.222678  0.218156  0.381035  1
  Cu  Cu55  1  0.702462  0.953292  0.387182  1
  Cu  Cu56  1  0.369128  0.953292  0.387182  1
  Cu  Cu57  1  0.300459  0.482632  0.374882  1
  Cu  Cu58  1  0.035795  0.953292  0.387182  1
  Cu  Cu59  1  0.967126  0.482632  0.374882  1
  Cu  Cu60  1  0.633793  0.482632  0.374882  1
  Cu  Cu61  1  0.095226  0.629152  0.418608  1
  Cu  Cu62  1  0.761892  0.629152  0.418608  1
  Cu  Cu63  1  0.693237  0.158854  0.405940  1
  Cu  Cu64  1  0.428559  0.629152  0.418608  1
  Cu  Cu65  1  0.359904  0.158854  0.405940  1
  Cu  Cu66  1  0.026571  0.158854  0.405940  1
  Cu  Cu67  1  0.506280  0.894224  0.412266  1
  Cu  Cu68  1  0.172947  0.894224  0.412266  1
  Cu  Cu69  1  0.104296  0.423297  0.399691  1
  Cu  Cu70  1  0.839613  0.894224  0.412266  1
  Cu  Cu71  1  0.770963  0.423297  0.399691  1
  Cu  Cu72  1  0.437630  0.423297  0.399691  1
  Cu  Cu73  1  0.898813  0.569763  0.443622  1
  Cu  Cu74  1  0.565479  0.569763  0.443622  1
  Cu  Cu75  1  0.496867  0.099425  0.431084  1
  Cu  Cu76  1  0.232146  0.569763  0.443622  1
  Cu  Cu77  1  0.163534  0.099425  0.431084  1
  Cu  Cu78  1  0.830201  0.099425  0.431084  1
  Cu  Cu79  1  0.309955  0.834695  0.437329  1
  Cu  Cu80  1  0.976622  0.834695  0.437329  1
  Cu  Cu81  1  0.908078  0.364258  0.424870  1
  Cu  Cu82  1  0.643289  0.834695  0.437329  1
  Cu  Cu83  1  0.574745  0.364258  0.424870  1
  Cu  Cu84  1  0.241412  0.364258  0.424870  1
  Cu  Cu85  1  0.702569  0.510532  0.468708  1
  Cu  Cu86  1  0.369236  0.510532  0.468708  1
  Cu  Cu87  1  0.300661  0.040198  0.456135  1
  Cu  Cu88  1  0.035902  0.510532  0.468708  1
  Cu  Cu89  1  0.967327  0.040198  0.456135  1
  Cu  Cu90  1  0.633994  0.040198  0.456135  1
  Cu  Cu91  1  0.113691  0.775428  0.462405  1
  Cu  Cu92  1  0.780357  0.775428  0.462405  1
  Cu  Cu93  1  0.711783  0.304959  0.449857  1
  Cu  Cu94  1  0.447024  0.775428  0.462405  1
  Cu  Cu95  1  0.378449  0.304959  0.449857  1
  Cu  Cu96  1  0.045116  0.304959  0.449857  1
  Cu  Cu97  1  0.506255  0.451208  0.493755  1
  Cu  Cu98  1  0.172922  0.451208  0.493755  1
  Cu  Cu99  1  0.104354  0.980838  0.481212  1
  Cu  Cu100  1  0.839588  0.451208  0.493755  1
  Cu  Cu101  1  0.771021  0.980838  0.481212  1
  Cu  Cu102  1  0.437688  0.980838  0.481212  1
  Cu  Cu103  1  0.917402  0.716074  0.487470  1
  Cu  Cu104  1  0.584069  0.716074  0.487470  1
  Cu  Cu105  1  0.515510  0.245692  0.474942  1
  Cu  Cu106  1  0.250735  0.716074  0.487470  1
  Cu  Cu107  1  0.182177  0.245692  0.474942  1
  Cu  Cu108  1  0.848843  0.245692  0.474942  1
  Cu  Cu109  1  0.309981  0.391946  0.518809  1
  Cu  Cu110  1  0.976648  0.391946  0.518809  1
  Cu  Cu111  1  0.908089  0.921563  0.506281  1
  Cu  Cu112  1  0.643314  0.391946  0.518809  1
  Cu  Cu113  1  0.574756  0.921563  0.506281  1
  Cu  Cu114  1  0.241422  0.921563  0.506281  1
  Cu  Cu115  1  0.721137  0.656800  0.512539  1
  Cu  Cu116  1  0.387803  0.656800  0.512539  1
  Cu  Cu117  1  0.319236  0.186429  0.499996  1
  Cu  Cu118  1  0.054470  0.656800  0.512539  1
  Cu  Cu119  1  0.985903  0.186429  0.499996  1
  Cu  Cu120  1  0.652569  0.186429  0.499996  1
  Cu  Cu121  1  0.113708  0.332679  0.543893  1
  Cu  Cu122  1  0.780375  0.332679  0.543893  1
  Cu  Cu123  1  0.711800  0.862209  0.531346  1
  Cu  Cu124  1  0.447042  0.332679  0.543893  1
  Cu  Cu125  1  0.378467  0.862209  0.531346  1
  Cu  Cu126  1  0.045134  0.862209  0.531346  1
  Cu  Cu127  1  0.524830  0.597439  0.537616  1
  Cu  Cu128  1  0.191497  0.597439  0.537616  1
  Cu  Cu129  1  0.122922  0.127106  0.525043  1
  Cu  Cu130  1  0.858164  0.597439  0.537616  1
  Cu  Cu131  1  0.789589  0.127106  0.525043  1
  Cu  Cu132  1  0.456255  0.127106  0.525043  1
  Cu  Cu133  1  0.917412  0.273380  0.568881  1
  Cu  Cu134  1  0.584079  0.273380  0.568881  1
  Cu  Cu135  1  0.515535  0.802942  0.556422  1
  Cu  Cu136  1  0.250746  0.273380  0.568881  1
  Cu  Cu137  1  0.182202  0.802942  0.556422  1
  Cu  Cu138  1  0.848869  0.802942  0.556422  1
  Cu  Cu139  1  0.328624  0.538212  0.562666  1
  Cu  Cu140  1  0.995290  0.538212  0.562666  1
  Cu  Cu141  1  0.926678  0.067874  0.550129  1
  Cu  Cu142  1  0.661957  0.538212  0.562666  1
  Cu  Cu143  1  0.593345  0.067874  0.550129  1
  Cu  Cu144  1  0.260011  0.067874  0.550129  1
  Cu  Cu145  1  0.721195  0.214340  0.594060  1
  Cu  Cu146  1  0.387861  0.214340  0.594060  1
  Cu  Cu147  1  0.319211  0.743413  0.581485  1
  Cu  Cu148  1  0.054528  0.214340  0.594060  1
  Cu  Cu149  1  0.985878  0.743413  0.581485  1
  Cu  Cu150  1  0.652544  0.743413  0.581485  1
  Cu  Cu151  1  0.132253  0.478784  0.587811  1
  Cu  Cu152  1  0.798920  0.478784  0.587811  1
  Cu  Cu153  1  0.730265  0.008485  0.575143  1
  Cu  Cu154  1  0.465587  0.478784  0.587811  1
  Cu  Cu155  1  0.396932  0.008485  0.575143  1
  Cu  Cu156  1  0.063599  0.008485  0.575143  1
  Cu  Cu157  1  0.525032  0.155006  0.618868  1
  Cu  Cu158  1  0.191698  0.155006  0.618868  1
  Cu  Cu159  1  0.123029  0.684345  0.606568  1
  Cu  Cu160  1  0.858365  0.155006  0.618868  1
  Cu  Cu161  1  0.789696  0.684345  0.606568  1
  Cu  Cu162  1  0.456363  0.684345  0.606568  1
  Cu  Cu163  1  0.936146  0.419481  0.612716  1
  Cu  Cu164  1  0.602812  0.419481  0.612716  1
  Cu  Cu165  1  0.534051  0.949268  0.600261  1
  Cu  Cu166  1  0.269479  0.419481  0.612716  1
  Cu  Cu167  1  0.200718  0.949268  0.600261  1
  Cu  Cu168  1  0.867384  0.949268  0.600261  1
  Cu  Cu169  1  0.328434  0.095736  0.644141  1
  Cu  Cu170  1  0.995101  0.095736  0.644141  1
  Cu  Cu171  1  0.926442  0.623785  0.631663  1
  Cu  Cu172  1  0.661767  0.095736  0.644141  1
  Cu  Cu173  1  0.593109  0.623785  0.631663  1
  Cu  Cu174  1  0.259775  0.623785  0.631663  1
  Cu  Cu175  1  0.740176  0.360809  0.638241  1
  Cu  Cu176  1  0.406843  0.360809  0.638241  1
  Cu  Cu177  1  0.337279  0.889182  0.625162  1
  Cu  Cu178  1  0.073509  0.360809  0.638241  1
  Cu  Cu179  1  1.003945  0.889182  0.625162  1
  Cu  Cu180  1  0.670612  0.889182  0.625162  1
  Cu  Cu181  1  0.131424  0.035871  0.668211  1
  Cu  Cu182  1  0.798091  0.035871  0.668211  1
  Cu  Cu183  1  0.729821  0.565401  0.656406  1
  Cu  Cu184  1  0.464758  0.035871  0.668211  1
  Cu  Cu185  1  0.396487  0.565401  0.656406  1
  Cu  Cu186  1  0.063154  0.565401  0.656406  1
  Cu  Cu187  1  0.543685  0.301498  0.662465  1
  Cu  Cu188  1  0.210352  0.301498  0.662465  1
  Cu  Cu189  1  0.141611  0.830520  0.650413  1
  Cu  Cu190  1  0.877019  0.301498  0.662465  1
  Cu  Cu191  1  0.808277  0.830520  0.650413  1
  Cu  Cu192  1  0.474944  0.830520  0.650413  1
  Cu  Cu193  1  0.934094  0.978211  0.694276  1
  Cu  Cu194  1  0.600760  0.978211  0.694276  1
  Cu  Cu195  1  0.535397  0.508425  0.682932  1
  Cu  Cu196  1  0.267427  0.978211  0.694276  1
  Cu  Cu197  1  0.202064  0.508425  0.682932  1
  Cu  Cu198  1  0.868730  0.508425  0.682932  1
  Cu  Cu199  1  0.348291  0.242213  0.688416  1
  Cu  Cu200  1  0.014958  0.242213  0.688416  1
  Cu  Cu201  1  0.944244  0.768326  0.674727  1
  Cu  Cu202  1  0.681624  0.242213  0.688416  1
  Cu  Cu203  1  0.610911  0.768326  0.674727  1
  Cu  Cu204  1  0.277577  0.768326  0.674727  1
  Cu  Cu205  1  0.733215  0.910343  0.716608  1
  Cu  Cu206  1  0.399881  0.910343  0.716608  1
  Cu  Cu207  1  0.339777  0.447409  0.706181  1
  Cu  Cu208  1  0.066548  0.910343  0.716608  1
  Cu  Cu209  1  0.006443  0.447409  0.706181  1
  Cu  Cu210  1  0.673110  0.447409  0.706181  1
  Cu  Cu211  1  0.150159  0.180442  0.711753  1
  Cu  Cu212  1  0.816825  0.180442  0.711753  1
  Cu  Cu213  1  0.753871  0.712094  0.700902  1
  Cu  Cu214  1  0.483492  0.180442  0.711753  1
  Cu  Cu215  1  0.420538  0.712094  0.700902  1
  Cu  Cu216  1  0.087204  0.712094  0.700902  1
