# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   13.21298882
_cell_length_b   11.29277019
_cell_length_c   46.64944815
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   125.87386961
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu
_chemical_formula_sum   Cu216
_cell_volume   5640.25473843
_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  0.078419  0.936133  0.294480  1
  Cu  Cu2  1  0.745086  0.936133  0.294480  1
  Cu  Cu3  1  0.678293  0.466243  0.283025  1
  Cu  Cu4  1  0.411752  0.936133  0.294480  1
  Cu  Cu5  1  0.344960  0.466243  0.283025  1
  Cu  Cu6  1  0.011626  0.466243  0.283025  1
  Cu  Cu7  1  0.492754  0.201556  0.289109  1
  Cu  Cu8  1  0.159421  0.201556  0.289109  1
  Cu  Cu9  1  0.090398  0.730609  0.277580  1
  Cu  Cu10  1  0.826087  0.201556  0.289109  1
  Cu  Cu11  1  0.757065  0.730609  0.277580  1
  Cu  Cu12  1  0.423732  0.730609  0.277580  1
  Cu  Cu13  1  0.885265  0.879846  0.319556  1
  Cu  Cu14  1  0.551932  0.879846  0.319556  1
  Cu  Cu15  1  0.481961  0.406947  0.306712  1
  Cu  Cu16  1  0.218598  0.879846  0.319556  1
  Cu  Cu17  1  0.148628  0.406947  0.306712  1
  Cu  Cu18  1  0.815295  0.406947  0.306712  1
  Cu  Cu19  1  0.296717  0.142142  0.312708  1
  Cu  Cu20  1  0.963383  0.142142  0.312708  1
  Cu  Cu21  1  0.894580  0.670574  0.300824  1
  Cu  Cu22  1  0.630050  0.142142  0.312708  1
  Cu  Cu23  1  0.561247  0.670574  0.300824  1
  Cu  Cu24  1  0.227913  0.670574  0.300824  1
  Cu  Cu25  1  0.689340  0.820239  0.344427  1
  Cu  Cu26  1  0.356007  0.820239  0.344427  1
  Cu  Cu27  1  0.287091  0.349048  0.332368  1
  Cu  Cu28  1  0.022673  0.820239  0.344427  1
  Cu  Cu29  1  0.953758  0.349048  0.332368  1
  Cu  Cu30  1  0.620425  0.349048  0.332368  1
  Cu  Cu31  1  0.101592  0.084771  0.338495  1
  Cu  Cu32  1  0.768259  0.084771  0.338495  1
  Cu  Cu33  1  0.698943  0.613477  0.326410  1
  Cu  Cu34  1  0.434926  0.084771  0.338495  1
  Cu  Cu35  1  0.365609  0.613477  0.326410  1
  Cu  Cu36  1  0.032276  0.613477  0.326410  1
  Cu  Cu37  1  0.494361  0.762610  0.369647  1
  Cu  Cu38  1  0.161028  0.762610  0.369647  1
  Cu  Cu39  1  0.091500  0.290761  0.356887  1
  Cu  Cu40  1  0.827695  0.762610  0.369647  1
  Cu  Cu41  1  0.758167  0.290761  0.356887  1
  Cu  Cu42  1  0.424833  0.290761  0.356887  1
  Cu  Cu43  1  0.905517  0.027021  0.363295  1
  Cu  Cu44  1  0.572183  0.027021  0.363295  1
  Cu  Cu45  1  0.502955  0.555137  0.350895  1
  Cu  Cu46  1  0.238850  0.027021  0.363295  1
  Cu  Cu47  1  0.169621  0.555137  0.350895  1
  Cu  Cu48  1  0.836288  0.555137  0.350895  1
  Cu  Cu49  1  0.298542  0.704127  0.394601  1
  Cu  Cu50  1  0.965209  0.704127  0.394601  1
  Cu  Cu51  1  0.896245  0.233064  0.382263  1
  Cu  Cu52  1  0.631876  0.704127  0.394601  1
  Cu  Cu53  1  0.562912  0.233064  0.382263  1
  Cu  Cu54  1  0.229579  0.233064  0.382263  1
  Cu  Cu55  1  0.709599  0.968479  0.388424  1
  Cu  Cu56  1  0.376266  0.968479  0.388424  1
  Cu  Cu57  1  0.307146  0.497283  0.376126  1
  Cu  Cu58  1  0.042932  0.968479  0.388424  1
  Cu  Cu59  1  0.973813  0.497283  0.376126  1
  Cu  Cu60  1  0.640480  0.497283  0.376126  1
  Cu  Cu61  1  0.102990  0.646141  0.419698  1
  Cu  Cu62  1  0.769656  0.646141  0.419698  1
  Cu  Cu63  1  0.700733  0.175071  0.407143  1
  Cu  Cu64  1  0.436323  0.646141  0.419698  1
  Cu  Cu65  1  0.367399  0.175071  0.407143  1
  Cu  Cu66  1  0.034066  0.175071  0.407143  1
  Cu  Cu67  1  0.513937  0.910638  0.413436  1
  Cu  Cu68  1  0.180604  0.910638  0.413436  1
  Cu  Cu69  1  0.111582  0.439276  0.400947  1
  Cu  Cu70  1  0.847270  0.910638  0.413436  1
  Cu  Cu71  1  0.778249  0.439276  0.400947  1
  Cu  Cu72  1  0.444916  0.439276  0.400947  1
  Cu  Cu73  1  0.907249  0.587997  0.444694  1
  Cu  Cu74  1  0.573916  0.587997  0.444694  1
  Cu  Cu75  1  0.505022  0.116922  0.432239  1
  Cu  Cu76  1  0.240583  0.587997  0.444694  1
  Cu  Cu77  1  0.171688  0.116922  0.432239  1
  Cu  Cu78  1  0.838355  0.116922  0.432239  1
  Cu  Cu79  1  0.318186  0.852421  0.438472  1
  Cu  Cu80  1  0.984853  0.852421  0.438472  1
  Cu  Cu81  1  0.915959  0.381386  0.426067  1
  Cu  Cu82  1  0.651520  0.852421  0.438472  1
  Cu  Cu83  1  0.582626  0.381386  0.426067  1
  Cu  Cu84  1  0.249292  0.381386  0.426067  1
  Cu  Cu85  1  0.711618  0.529993  0.469751  1
  Cu  Cu86  1  0.378284  0.529993  0.469751  1
  Cu  Cu87  1  0.309403  0.058938  0.457237  1
  Cu  Cu88  1  0.044951  0.529993  0.469751  1
  Cu  Cu89  1  0.976070  0.058938  0.457237  1
  Cu  Cu90  1  0.642737  0.058938  0.457237  1
  Cu  Cu91  1  0.122521  0.794434  0.463504  1
  Cu  Cu92  1  0.789188  0.794434  0.463504  1
  Cu  Cu93  1  0.720285  0.323340  0.451017  1
  Cu  Cu94  1  0.455855  0.794434  0.463504  1
  Cu  Cu95  1  0.386952  0.323340  0.451017  1
  Cu  Cu96  1  0.053618  0.323340  0.451017  1
  Cu  Cu97  1  0.515914  0.471899  0.494764  1
  Cu  Cu98  1  0.182581  0.471899  0.494764  1
  Cu  Cu99  1  0.113693  1.000829  0.482275  1
  Cu  Cu100  1  0.849248  0.471899  0.494764  1
  Cu  Cu101  1  0.780360  1.000829  0.482275  1
  Cu  Cu102  1  0.447027  1.000829  0.482275  1
  Cu  Cu103  1  0.926824  0.736337  0.488535  1
  Cu  Cu104  1  0.593491  0.736337  0.488535  1
  Cu  Cu105  1  0.524608  0.265291  0.476059  1
  Cu  Cu106  1  0.260157  0.736337  0.488535  1
  Cu  Cu107  1  0.191275  0.265291  0.476059  1
  Cu  Cu108  1  0.857942  0.265291  0.476059  1
  Cu  Cu109  1  0.320245  0.413867  0.519778  1
  Cu  Cu110  1  0.986911  0.413867  0.519778  1
  Cu  Cu111  1  0.918029  0.942821  0.507303  1
  Cu  Cu112  1  0.653578  0.413867  0.519778  1
  Cu  Cu113  1  0.584696  0.942821  0.507303  1
  Cu  Cu114  1  0.251362  0.942821  0.507303  1
  Cu  Cu115  1  0.731160  0.678330  0.513562  1
  Cu  Cu116  1  0.397826  0.678330  0.513562  1
  Cu  Cu117  1  0.328939  0.207259  0.501073  1
  Cu  Cu118  1  0.064493  0.678330  0.513562  1
  Cu  Cu119  1  0.995605  0.207259  0.501073  1
  Cu  Cu120  1  0.662272  0.207259  0.501073  1
  Cu  Cu121  1  0.124568  0.355819  0.544820  1
  Cu  Cu122  1  0.791235  0.355819  0.544820  1
  Cu  Cu123  1  0.722332  0.884725  0.532334  1
  Cu  Cu124  1  0.457901  0.355819  0.544820  1
  Cu  Cu125  1  0.388998  0.884725  0.532334  1
  Cu  Cu126  1  0.055665  0.884725  0.532334  1
  Cu  Cu127  1  0.535450  0.620221  0.538601  1
  Cu  Cu128  1  0.202116  0.620221  0.538601  1
  Cu  Cu129  1  0.133235  0.149166  0.526087  1
  Cu  Cu130  1  0.868783  0.620221  0.538601  1
  Cu  Cu131  1  0.799902  0.149166  0.526087  1
  Cu  Cu132  1  0.466569  0.149166  0.526087  1
  Cu  Cu133  1  0.928894  0.297772  0.569771  1
  Cu  Cu134  1  0.595561  0.297772  0.569771  1
  Cu  Cu135  1  0.526667  0.826738  0.557365  1
  Cu  Cu136  1  0.262227  0.297772  0.569771  1
  Cu  Cu137  1  0.193333  0.826738  0.557365  1
  Cu  Cu138  1  0.860000  0.826738  0.557365  1
  Cu  Cu139  1  0.339831  0.562237  0.563598  1
  Cu  Cu140  1  0.006498  0.562237  0.563598  1
  Cu  Cu141  1  0.937604  0.091161  0.551143  1
  Cu  Cu142  1  0.673165  0.562237  0.563598  1
  Cu  Cu143  1  0.604270  0.091161  0.551143  1
  Cu  Cu144  1  0.270937  0.091161  0.551143  1
  Cu  Cu145  1  0.733271  0.239883  0.594890  1
  Cu  Cu146  1  0.399937  0.239883  0.594890  1
  Cu  Cu147  1  0.330916  0.768521  0.582402  1
  Cu  Cu148  1  0.066604  0.239883  0.594890  1
  Cu  Cu149  1  0.997583  0.768521  0.582402  1
  Cu  Cu150  1  0.664249  0.768521  0.582402  1
  Cu  Cu151  1  0.144120  0.504088  0.588694  1
  Cu  Cu152  1  0.810787  0.504088  0.588694  1
  Cu  Cu153  1  0.741863  0.033018  0.576139  1
  Cu  Cu154  1  0.477454  0.504088  0.588694  1
  Cu  Cu155  1  0.408530  0.033018  0.576139  1
  Cu  Cu156  1  0.075197  0.033018  0.576139  1
  Cu  Cu157  1  0.537707  0.181876  0.619711  1
  Cu  Cu158  1  0.204373  0.181876  0.619711  1
  Cu  Cu159  1  0.135254  0.710680  0.607414  1
  Cu  Cu160  1  0.871040  0.181876  0.619711  1
  Cu  Cu161  1  0.801921  0.710680  0.607414  1
  Cu  Cu162  1  0.468588  0.710680  0.607414  1
  Cu  Cu163  1  0.948608  0.446095  0.613574  1
  Cu  Cu164  1  0.615274  0.446095  0.613574  1
  Cu  Cu165  1  0.546311  0.975032  0.601237  1
  Cu  Cu166  1  0.281941  0.446095  0.613574  1
  Cu  Cu167  1  0.212977  0.975032  0.601237  1
  Cu  Cu168  1  0.879644  0.975032  0.601237  1
  Cu  Cu169  1  0.341898  0.124022  0.644943  1
  Cu  Cu170  1  0.008565  0.124022  0.644943  1
  Cu  Cu171  1  0.939336  0.652138  0.632542  1
  Cu  Cu172  1  0.675232  0.124022  0.644943  1
  Cu  Cu173  1  0.606003  0.652138  0.632542  1
  Cu  Cu174  1  0.272670  0.652138  0.632542  1
  Cu  Cu175  1  0.753353  0.388398  0.638950  1
  Cu  Cu176  1  0.420020  0.388398  0.638950  1
  Cu  Cu177  1  0.350492  0.916549  0.626191  1
  Cu  Cu178  1  0.086686  0.388398  0.638950  1
  Cu  Cu179  1  0.017158  0.916549  0.626191  1
  Cu  Cu180  1  0.683825  0.916549  0.626191  1
  Cu  Cu181  1  0.145910  0.065681  0.669428  1
  Cu  Cu182  1  0.812577  0.065681  0.669428  1
  Cu  Cu183  1  0.743261  0.594387  0.657343  1
  Cu  Cu184  1  0.479244  0.065681  0.669428  1
  Cu  Cu185  1  0.409927  0.594387  0.657343  1
  Cu  Cu186  1  0.076594  0.594387  0.657343  1
  Cu  Cu187  1  0.557762  0.330111  0.663469  1
  Cu  Cu188  1  0.224428  0.330111  0.663469  1
  Cu  Cu189  1  0.155513  0.858919  0.651411  1
  Cu  Cu190  1  0.891095  0.330111  0.663469  1
  Cu  Cu191  1  0.822180  0.858919  0.651411  1
  Cu  Cu192  1  0.488846  0.858919  0.651411  1
  Cu  Cu193  1  0.950273  0.008585  0.695013  1
  Cu  Cu194  1  0.616940  0.008585  0.695013  1
  Cu  Cu195  1  0.548136  0.537016  0.683129  1
  Cu  Cu196  1  0.283606  0.008585  0.695013  1
  Cu  Cu197  1  0.214803  0.537016  0.683129  1
  Cu  Cu198  1  0.881470  0.537016  0.683129  1
  Cu  Cu199  1  0.362892  0.272212  0.689125  1
  Cu  Cu200  1  0.029558  0.272212  0.689125  1
  Cu  Cu201  1  0.959588  0.799313  0.676282  1
  Cu  Cu202  1  0.696225  0.272212  0.689125  1
  Cu  Cu203  1  0.626255  0.799313  0.676282  1
  Cu  Cu204  1  0.292921  0.799313  0.676282  1
  Cu  Cu205  1  0.754455  0.948549  0.718258  1
  Cu  Cu206  1  0.421121  0.948549  0.718258  1
  Cu  Cu207  1  0.352099  0.477603  0.706729  1
  Cu  Cu208  1  0.087788  0.948549  0.718258  1
  Cu  Cu209  1  0.018766  0.477603  0.706729  1
  Cu  Cu210  1  0.685432  0.477603  0.706729  1
  Cu  Cu211  1  0.166560  0.212916  0.712812  1
  Cu  Cu212  1  0.833227  0.212916  0.712812  1
  Cu  Cu213  1  0.766434  0.743026  0.701357  1
  Cu  Cu214  1  0.499893  0.212916  0.712812  1
  Cu  Cu215  1  0.433101  0.743026  0.701357  1
  Cu  Cu216  1  0.099767  0.743026  0.701357  1
