# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.20974038
_cell_length_b   12.98901160
_cell_length_c   46.28654386
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   113.09346927
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu
_chemical_formula_sum   Cu216
_cell_volume   5646.38157293
_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  0.738537  0.266403  0.311112  1
  Cu  Cu2  1  0.238537  0.266403  0.311112  1
  Cu  Cu3  1  0.172017  0.633238  0.295272  1
  Cu  Cu4  1  0.605170  0.999694  0.280055  1
  Cu  Cu5  1  0.672017  0.633238  0.295272  1
  Cu  Cu6  1  0.105170  0.999694  0.280055  1
  Cu  Cu7  1  0.273801  0.086995  0.320982  1
  Cu  Cu8  1  0.773801  0.086995  0.320982  1
  Cu  Cu9  1  0.705382  0.450000  0.303384  1
  Cu  Cu10  1  0.138743  0.816718  0.287201  1
  Cu  Cu11  1  0.205382  0.450000  0.303384  1
  Cu  Cu12  1  0.638743  0.816718  0.287201  1
  Cu  Cu13  1  0.523801  0.086995  0.320982  1
  Cu  Cu14  1  0.023801  0.086995  0.320982  1
  Cu  Cu15  1  0.955382  0.450000  0.303384  1
  Cu  Cu16  1  0.388743  0.816718  0.287201  1
  Cu  Cu17  1  0.455382  0.450000  0.303384  1
  Cu  Cu18  1  0.888743  0.816718  0.287201  1
  Cu  Cu19  1  0.488537  0.266403  0.311112  1
  Cu  Cu20  1  0.988537  0.266403  0.311112  1
  Cu  Cu21  1  0.922017  0.633238  0.295272  1
  Cu  Cu22  1  0.355170  0.999694  0.280055  1
  Cu  Cu23  1  0.422017  0.633238  0.295272  1
  Cu  Cu24  1  0.855170  0.999694  0.280055  1
  Cu  Cu25  1  0.444114  0.177799  0.362079  1
  Cu  Cu26  1  0.944114  0.177799  0.362079  1
  Cu  Cu27  1  0.875529  0.540533  0.344910  1
  Cu  Cu28  1  0.307671  0.904748  0.328919  1
  Cu  Cu29  1  0.375529  0.540533  0.344910  1
  Cu  Cu30  1  0.807671  0.904748  0.328919  1
  Cu  Cu31  1  0.977879  0.995373  0.370580  1
  Cu  Cu32  1  0.477879  0.995373  0.370580  1
  Cu  Cu33  1  0.409291  0.358126  0.352899  1
  Cu  Cu34  1  0.841648  0.722723  0.336820  1
  Cu  Cu35  1  0.909291  0.358126  0.352899  1
  Cu  Cu36  1  0.341648  0.722723  0.336820  1
  Cu  Cu37  1  0.227879  0.995373  0.370580  1
  Cu  Cu38  1  0.727879  0.995373  0.370580  1
  Cu  Cu39  1  0.659291  0.358126  0.352899  1
  Cu  Cu40  1  0.091648  0.722723  0.336820  1
  Cu  Cu41  1  0.159291  0.358126  0.352899  1
  Cu  Cu42  1  0.591648  0.722723  0.336820  1
  Cu  Cu43  1  0.194114  0.177799  0.362079  1
  Cu  Cu44  1  0.694114  0.177799  0.362079  1
  Cu  Cu45  1  0.625529  0.540533  0.344910  1
  Cu  Cu46  1  0.057671  0.904748  0.328919  1
  Cu  Cu47  1  0.125529  0.540533  0.344910  1
  Cu  Cu48  1  0.557671  0.904748  0.328919  1
  Cu  Cu49  1  0.148115  0.086054  0.412102  1
  Cu  Cu50  1  0.648115  0.086054  0.412102  1
  Cu  Cu51  1  0.579618  0.448989  0.394853  1
  Cu  Cu52  1  0.011692  0.813039  0.378673  1
  Cu  Cu53  1  0.079618  0.448989  0.394853  1
  Cu  Cu54  1  0.511692  0.813039  0.378673  1
  Cu  Cu55  1  0.681953  0.903778  0.420393  1
  Cu  Cu56  1  0.181953  0.903778  0.420393  1
  Cu  Cu57  1  0.114096  0.267969  0.403568  1
  Cu  Cu58  1  0.545652  0.631004  0.386757  1
  Cu  Cu59  1  0.614096  0.267969  0.403568  1
  Cu  Cu60  1  0.045652  0.631004  0.386757  1
  Cu  Cu61  1  0.931953  0.903778  0.420393  1
  Cu  Cu62  1  0.431953  0.903778  0.420393  1
  Cu  Cu63  1  0.364096  0.267969  0.403568  1
  Cu  Cu64  1  0.795652  0.631004  0.386757  1
  Cu  Cu65  1  0.864096  0.267969  0.403568  1
  Cu  Cu66  1  0.295652  0.631004  0.386757  1
  Cu  Cu67  1  0.898115  0.086054  0.412102  1
  Cu  Cu68  1  0.398115  0.086054  0.412102  1
  Cu  Cu69  1  0.329618  0.448989  0.394853  1
  Cu  Cu70  1  0.761692  0.813039  0.378673  1
  Cu  Cu71  1  0.829618  0.448989  0.394853  1
  Cu  Cu72  1  0.261692  0.813039  0.378673  1
  Cu  Cu73  1  0.852172  0.994429  0.462049  1
  Cu  Cu74  1  0.352172  0.994429  0.462049  1
  Cu  Cu75  1  0.284151  0.358293  0.445206  1
  Cu  Cu76  1  0.715885  0.721687  0.428579  1
  Cu  Cu77  1  0.784151  0.358293  0.445206  1
  Cu  Cu78  1  0.215885  0.721687  0.428579  1
  Cu  Cu79  1  0.386148  0.812427  0.470348  1
  Cu  Cu80  1  0.886148  0.812427  0.470348  1
  Cu  Cu81  1  0.818230  0.176495  0.453682  1
  Cu  Cu82  1  0.249892  0.539745  0.436740  1
  Cu  Cu83  1  0.318230  0.176495  0.453682  1
  Cu  Cu84  1  0.749892  0.539745  0.436740  1
  Cu  Cu85  1  0.636148  0.812427  0.470348  1
  Cu  Cu86  1  0.136148  0.812427  0.470348  1
  Cu  Cu87  1  0.068230  0.176495  0.453682  1
  Cu  Cu88  1  0.499892  0.539745  0.436740  1
  Cu  Cu89  1  0.568230  0.176495  0.453682  1
  Cu  Cu90  1  0.999892  0.539745  0.436740  1
  Cu  Cu91  1  0.602172  0.994429  0.462049  1
  Cu  Cu92  1  0.102172  0.994429  0.462049  1
  Cu  Cu93  1  0.034151  0.358293  0.445206  1
  Cu  Cu94  1  0.465885  0.721687  0.428579  1
  Cu  Cu95  1  0.534151  0.358293  0.445206  1
  Cu  Cu96  1  0.965885  0.721687  0.428579  1
  Cu  Cu97  1  0.556367  0.903077  0.512081  1
  Cu  Cu98  1  0.056367  0.903077  0.512081  1
  Cu  Cu99  1  0.988344  0.266937  0.495300  1
  Cu  Cu100  1  0.420183  0.630536  0.478582  1
  Cu  Cu101  1  0.488344  0.266937  0.495300  1
  Cu  Cu102  1  0.920183  0.630536  0.478582  1
  Cu  Cu103  1  0.090482  0.721342  0.520407  1
  Cu  Cu104  1  0.590482  0.721342  0.520407  1
  Cu  Cu105  1  0.522321  0.084942  0.503689  1
  Cu  Cu106  1  0.954298  0.448801  0.486908  1
  Cu  Cu107  1  0.022321  0.084942  0.503689  1
  Cu  Cu108  1  0.454298  0.448801  0.486908  1
  Cu  Cu109  1  0.340482  0.721342  0.520407  1
  Cu  Cu110  1  0.840482  0.721342  0.520407  1
  Cu  Cu111  1  0.772321  0.084942  0.503689  1
  Cu  Cu112  1  0.204298  0.448801  0.486908  1
  Cu  Cu113  1  0.272321  0.084942  0.503689  1
  Cu  Cu114  1  0.704298  0.448801  0.486908  1
  Cu  Cu115  1  0.306367  0.903077  0.512081  1
  Cu  Cu116  1  0.806367  0.903077  0.512081  1
  Cu  Cu117  1  0.738344  0.266937  0.495300  1
  Cu  Cu118  1  0.170183  0.630536  0.478582  1
  Cu  Cu119  1  0.238344  0.266937  0.495300  1
  Cu  Cu120  1  0.670183  0.630536  0.478582  1
  Cu  Cu121  1  0.260773  0.812133  0.562249  1
  Cu  Cu122  1  0.760773  0.812133  0.562249  1
  Cu  Cu123  1  0.692436  0.175384  0.545307  1
  Cu  Cu124  1  0.124517  0.539451  0.528642  1
  Cu  Cu125  1  0.192436  0.175384  0.545307  1
  Cu  Cu126  1  0.624517  0.539451  0.528642  1
  Cu  Cu127  1  0.794780  0.630191  0.570410  1
  Cu  Cu128  1  0.294780  0.630191  0.570410  1
  Cu  Cu129  1  0.226514  0.993585  0.553783  1
  Cu  Cu130  1  0.658493  0.357449  0.536941  1
  Cu  Cu131  1  0.726514  0.993585  0.553783  1
  Cu  Cu132  1  0.158493  0.357449  0.536941  1
  Cu  Cu133  1  0.044780  0.630191  0.570410  1
  Cu  Cu134  1  0.544780  0.630191  0.570410  1
  Cu  Cu135  1  0.476514  0.993585  0.553783  1
  Cu  Cu136  1  0.908493  0.357449  0.536941  1
  Cu  Cu137  1  0.976514  0.993585  0.553783  1
  Cu  Cu138  1  0.408493  0.357449  0.536941  1
  Cu  Cu139  1  0.010773  0.812133  0.562249  1
  Cu  Cu140  1  0.510773  0.812133  0.562249  1
  Cu  Cu141  1  0.442436  0.175384  0.545307  1
  Cu  Cu142  1  0.874517  0.539451  0.528642  1
  Cu  Cu143  1  0.942436  0.175384  0.545307  1
  Cu  Cu144  1  0.374517  0.539451  0.528642  1
  Cu  Cu145  1  0.965013  0.720874  0.612232  1
  Cu  Cu146  1  0.465013  0.720874  0.612232  1
  Cu  Cu147  1  0.396569  0.083909  0.595421  1
  Cu  Cu148  1  0.828712  0.448100  0.578596  1
  Cu  Cu149  1  0.896569  0.083909  0.595421  1
  Cu  Cu150  1  0.328712  0.448100  0.578596  1
  Cu  Cu151  1  0.498973  0.538839  0.620316  1
  Cu  Cu152  1  0.998973  0.538839  0.620316  1
  Cu  Cu153  1  0.931047  0.902890  0.604136  1
  Cu  Cu154  1  0.362550  0.265824  0.586887  1
  Cu  Cu155  1  0.431047  0.902890  0.604136  1
  Cu  Cu156  1  0.862550  0.265824  0.586887  1
  Cu  Cu157  1  0.748973  0.538839  0.620316  1
  Cu  Cu158  1  0.248973  0.538839  0.620316  1
  Cu  Cu159  1  0.181047  0.902890  0.604136  1
  Cu  Cu160  1  0.612550  0.265824  0.586887  1
  Cu  Cu161  1  0.681047  0.902890  0.604136  1
  Cu  Cu162  1  0.112550  0.265824  0.586887  1
  Cu  Cu163  1  0.715013  0.720874  0.612232  1
  Cu  Cu164  1  0.215013  0.720874  0.612232  1
  Cu  Cu165  1  0.146569  0.083909  0.595421  1
  Cu  Cu166  1  0.578712  0.448100  0.578596  1
  Cu  Cu167  1  0.646569  0.083909  0.595421  1
  Cu  Cu168  1  0.078712  0.448100  0.578596  1
  Cu  Cu169  1  0.669018  0.629155  0.662169  1
  Cu  Cu170  1  0.169018  0.629155  0.662169  1
  Cu  Cu171  1  0.101375  0.993752  0.646091  1
  Cu  Cu172  1  0.532786  0.356505  0.628409  1
  Cu  Cu173  1  0.601375  0.993752  0.646091  1
  Cu  Cu174  1  0.032786  0.356505  0.628409  1
  Cu  Cu175  1  0.202994  0.447130  0.670070  1
  Cu  Cu176  1  0.702994  0.447130  0.670070  1
  Cu  Cu177  1  0.635136  0.811345  0.654080  1
  Cu  Cu178  1  0.066552  0.174079  0.636911  1
  Cu  Cu179  1  0.135136  0.811345  0.654080  1
  Cu  Cu180  1  0.566552  0.174079  0.636911  1
  Cu  Cu181  1  0.452994  0.447130  0.670070  1
  Cu  Cu182  1  0.952994  0.447130  0.670070  1
  Cu  Cu183  1  0.885136  0.811345  0.654080  1
  Cu  Cu184  1  0.316552  0.174079  0.636911  1
  Cu  Cu185  1  0.385136  0.811345  0.654080  1
  Cu  Cu186  1  0.816552  0.174079  0.636911  1
  Cu  Cu187  1  0.419018  0.629155  0.662169  1
  Cu  Cu188  1  0.919018  0.629155  0.662169  1
  Cu  Cu189  1  0.851375  0.993752  0.646091  1
  Cu  Cu190  1  0.282786  0.356505  0.628409  1
  Cu  Cu191  1  0.351375  0.993752  0.646091  1
  Cu  Cu192  1  0.782786  0.356505  0.628409  1
  Cu  Cu193  1  0.371922  0.535160  0.711788  1
  Cu  Cu194  1  0.871922  0.535160  0.711788  1
  Cu  Cu195  1  0.805283  0.901878  0.695605  1
  Cu  Cu196  1  0.236864  0.264883  0.678007  1
  Cu  Cu197  1  0.305283  0.901878  0.695605  1
  Cu  Cu198  1  0.736864  0.264883  0.678007  1
  Cu  Cu199  1  0.905495  0.352184  0.718935  1
  Cu  Cu200  1  0.405495  0.352184  0.718935  1
  Cu  Cu201  1  0.338649  0.718641  0.703717  1
  Cu  Cu202  1  0.772128  0.085475  0.687877  1
  Cu  Cu203  1  0.838649  0.718641  0.703717  1
  Cu  Cu204  1  0.272128  0.085475  0.687877  1
  Cu  Cu205  1  0.155495  0.352184  0.718935  1
  Cu  Cu206  1  0.655495  0.352184  0.718935  1
  Cu  Cu207  1  0.588649  0.718641  0.703717  1
  Cu  Cu208  1  0.022128  0.085475  0.687877  1
  Cu  Cu209  1  0.088649  0.718641  0.703717  1
  Cu  Cu210  1  0.522128  0.085475  0.687877  1
  Cu  Cu211  1  0.121922  0.535160  0.711788  1
  Cu  Cu212  1  0.621922  0.535160  0.711788  1
  Cu  Cu213  1  0.555283  0.901878  0.695605  1
  Cu  Cu214  1  0.986864  0.264883  0.678007  1
  Cu  Cu215  1  0.055283  0.901878  0.695605  1
  Cu  Cu216  1  0.486864  0.264883  0.678007  1
