# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   13.50003718
_cell_length_b   13.58385582
_cell_length_c   46.97428827
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   94.08251866
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu
_chemical_formula_sum   Cu324
_cell_volume   8592.40690954
_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  0.248415  0.665547  0.303978  1
  Cu  Cu2  1  0.258158  0.309585  0.320232  1
  Cu  Cu3  1  0.405280  0.353368  0.288551  1
  Cu  Cu4  1  0.581748  0.332214  0.303978  1
  Cu  Cu5  1  0.238613  0.020035  0.288551  1
  Cu  Cu6  1  0.415082  0.998880  0.303978  1
  Cu  Cu7  1  0.424824  0.642919  0.320232  1
  Cu  Cu8  1  0.571947  0.686701  0.288551  1
  Cu  Cu9  1  0.748415  0.665547  0.303978  1
  Cu  Cu10  1  0.758158  0.309585  0.320232  1
  Cu  Cu11  1  0.905280  0.353368  0.288551  1
  Cu  Cu12  1  0.081748  0.332214  0.303978  1
  Cu  Cu13  1  0.591491  0.976252  0.320232  1
  Cu  Cu14  1  0.738613  0.020035  0.288551  1
  Cu  Cu15  1  0.915082  0.998880  0.303978  1
  Cu  Cu16  1  0.924824  0.642919  0.320232  1
  Cu  Cu17  1  0.071947  0.686701  0.288551  1
  Cu  Cu18  1  0.091491  0.976252  0.320232  1
  Cu  Cu19  1  0.298452  0.845985  0.294125  1
  Cu  Cu20  1  0.307198  0.490553  0.309620  1
  Cu  Cu21  1  0.457924  0.533430  0.278771  1
  Cu  Cu22  1  0.631786  0.512652  0.294125  1
  Cu  Cu23  1  0.291258  0.200097  0.278771  1
  Cu  Cu24  1  0.465119  0.179318  0.294125  1
  Cu  Cu25  1  0.473865  0.823886  0.309620  1
  Cu  Cu26  1  0.624591  0.866764  0.278771  1
  Cu  Cu27  1  0.798452  0.845985  0.294125  1
  Cu  Cu28  1  0.807198  0.490553  0.309620  1
  Cu  Cu29  1  0.957924  0.533430  0.278771  1
  Cu  Cu30  1  0.131786  0.512652  0.294125  1
  Cu  Cu31  1  0.640532  0.157220  0.309620  1
  Cu  Cu32  1  0.791258  0.200097  0.278771  1
  Cu  Cu33  1  0.965119  0.179318  0.294125  1
  Cu  Cu34  1  0.973865  0.823886  0.309620  1
  Cu  Cu35  1  0.124591  0.866764  0.278771  1
  Cu  Cu36  1  0.140532  0.157220  0.309620  1
  Cu  Cu37  1  0.279002  0.596313  0.353442  1
  Cu  Cu38  1  0.288970  0.240367  0.370396  1
  Cu  Cu39  1  0.435247  0.285541  0.336981  1
  Cu  Cu40  1  0.612335  0.262979  0.353442  1
  Cu  Cu41  1  0.268580  0.952208  0.336981  1
  Cu  Cu42  1  0.445669  0.929646  0.353442  1
  Cu  Cu43  1  0.455637  0.573700  0.370396  1
  Cu  Cu44  1  0.601913  0.618874  0.336981  1
  Cu  Cu45  1  0.779002  0.596313  0.353442  1
  Cu  Cu46  1  0.788970  0.240367  0.370396  1
  Cu  Cu47  1  0.935247  0.285541  0.336981  1
  Cu  Cu48  1  0.112335  0.262979  0.353442  1
  Cu  Cu49  1  0.622303  0.907033  0.370396  1
  Cu  Cu50  1  0.768580  0.952208  0.336981  1
  Cu  Cu51  1  0.945669  0.929646  0.353442  1
  Cu  Cu52  1  0.955637  0.573700  0.370396  1
  Cu  Cu53  1  0.101913  0.618874  0.336981  1
  Cu  Cu54  1  0.122303  0.907033  0.370396  1
  Cu  Cu55  1  0.327641  0.777825  0.342951  1
  Cu  Cu56  1  0.337299  0.421667  0.359336  1
  Cu  Cu57  1  0.484055  0.467447  0.326594  1
  Cu  Cu58  1  0.660974  0.444491  0.342951  1
  Cu  Cu59  1  0.317388  0.134114  0.326594  1
  Cu  Cu60  1  0.494308  0.111158  0.342951  1
  Cu  Cu61  1  0.503966  0.755000  0.359336  1
  Cu  Cu62  1  0.650721  0.800781  0.326594  1
  Cu  Cu63  1  0.827641  0.777825  0.342951  1
  Cu  Cu64  1  0.837299  0.421667  0.359336  1
  Cu  Cu65  1  0.984055  0.467447  0.326594  1
  Cu  Cu66  1  0.160974  0.444491  0.342951  1
  Cu  Cu67  1  0.670633  0.088334  0.359336  1
  Cu  Cu68  1  0.817388  0.134114  0.326594  1
  Cu  Cu69  1  0.994308  0.111158  0.342951  1
  Cu  Cu70  1  0.003966  0.755000  0.359336  1
  Cu  Cu71  1  0.150721  0.800781  0.326594  1
  Cu  Cu72  1  0.170633  0.088334  0.359336  1
  Cu  Cu73  1  0.309593  0.527646  0.403750  1
  Cu  Cu74  1  0.319914  0.171425  0.420559  1
  Cu  Cu75  1  0.466076  0.217287  0.387092  1
  Cu  Cu76  1  0.642927  0.194313  0.403750  1
  Cu  Cu77  1  0.299410  0.883954  0.387092  1
  Cu  Cu78  1  0.476260  0.860980  0.403750  1
  Cu  Cu79  1  0.486581  0.504758  0.420559  1
  Cu  Cu80  1  0.632743  0.550620  0.387092  1
  Cu  Cu81  1  0.809593  0.527646  0.403750  1
  Cu  Cu82  1  0.819914  0.171425  0.420559  1
  Cu  Cu83  1  0.966076  0.217287  0.387092  1
  Cu  Cu84  1  0.142927  0.194313  0.403750  1
  Cu  Cu85  1  0.653247  0.838092  0.420559  1
  Cu  Cu86  1  0.799410  0.883954  0.387092  1
  Cu  Cu87  1  0.976260  0.860980  0.403750  1
  Cu  Cu88  1  0.986581  0.504758  0.420559  1
  Cu  Cu89  1  0.132743  0.550620  0.387092  1
  Cu  Cu90  1  0.153247  0.838092  0.420559  1
  Cu  Cu91  1  0.357436  0.709218  0.392885  1
  Cu  Cu92  1  0.367601  0.353111  0.409615  1
  Cu  Cu93  1  0.514064  0.398721  0.376205  1
  Cu  Cu94  1  0.690770  0.375884  0.392885  1
  Cu  Cu95  1  0.347397  0.065388  0.376205  1
  Cu  Cu96  1  0.524103  0.042551  0.392885  1
  Cu  Cu97  1  0.534267  0.686444  0.409615  1
  Cu  Cu98  1  0.680730  0.732055  0.376205  1
  Cu  Cu99  1  0.857436  0.709218  0.392885  1
  Cu  Cu100  1  0.867601  0.353111  0.409615  1
  Cu  Cu101  1  0.014064  0.398721  0.376205  1
  Cu  Cu102  1  0.190770  0.375884  0.392885  1
  Cu  Cu103  1  0.700934  0.019777  0.409615  1
  Cu  Cu104  1  0.847397  0.065388  0.376205  1
  Cu  Cu105  1  0.024103  0.042551  0.392885  1
  Cu  Cu106  1  0.034267  0.686444  0.409615  1
  Cu  Cu107  1  0.180730  0.732055  0.376205  1
  Cu  Cu108  1  0.200934  0.019777  0.409615  1
  Cu  Cu109  1  0.340398  0.458890  0.453997  1
  Cu  Cu110  1  0.350659  0.102640  0.470738  1
  Cu  Cu111  1  0.496858  0.148474  0.437266  1
  Cu  Cu112  1  0.673732  0.125557  0.453997  1
  Cu  Cu113  1  0.330191  0.815140  0.437266  1
  Cu  Cu114  1  0.507065  0.792223  0.453997  1
  Cu  Cu115  1  0.517325  0.435974  0.470738  1
  Cu  Cu116  1  0.663525  0.481807  0.437266  1
  Cu  Cu117  1  0.840398  0.458890  0.453997  1
  Cu  Cu118  1  0.850659  0.102640  0.470738  1
  Cu  Cu119  1  0.996858  0.148474  0.437266  1
  Cu  Cu120  1  0.173732  0.125557  0.453997  1
  Cu  Cu121  1  0.683992  0.769307  0.470738  1
  Cu  Cu122  1  0.830191  0.815140  0.437266  1
  Cu  Cu123  1  0.007065  0.792223  0.453997  1
  Cu  Cu124  1  0.017325  0.435974  0.470738  1
  Cu  Cu125  1  0.163525  0.481807  0.437266  1
  Cu  Cu126  1  0.183992  0.769307  0.470738  1
  Cu  Cu127  1  0.388009  0.640506  0.443049  1
  Cu  Cu128  1  0.398260  0.284288  0.459800  1
  Cu  Cu129  1  0.544460  0.330124  0.426363  1
  Cu  Cu130  1  0.721342  0.307173  0.443049  1
  Cu  Cu131  1  0.377793  0.996791  0.426363  1
  Cu  Cu132  1  0.554675  0.973839  0.443049  1
  Cu  Cu133  1  0.564926  0.617622  0.459800  1
  Cu  Cu134  1  0.711126  0.663457  0.426363  1
  Cu  Cu135  1  0.888009  0.640506  0.443049  1
  Cu  Cu136  1  0.898260  0.284288  0.459800  1
  Cu  Cu137  1  0.044460  0.330124  0.426363  1
  Cu  Cu138  1  0.221342  0.307173  0.443049  1
  Cu  Cu139  1  0.731593  0.950955  0.459800  1
  Cu  Cu140  1  0.877793  0.996791  0.426363  1
  Cu  Cu141  1  0.054675  0.973839  0.443049  1
  Cu  Cu142  1  0.064926  0.617622  0.459800  1
  Cu  Cu143  1  0.211126  0.663457  0.426363  1
  Cu  Cu144  1  0.231593  0.950955  0.459800  1
  Cu  Cu145  1  0.371157  0.390117  0.504198  1
  Cu  Cu146  1  0.381404  0.033866  0.520915  1
  Cu  Cu147  1  0.527576  0.079698  0.487453  1
  Cu  Cu148  1  0.704490  0.056784  0.504198  1
  Cu  Cu149  1  0.360910  0.746365  0.487453  1
  Cu  Cu150  1  0.537823  0.723451  0.504198  1
  Cu  Cu151  1  0.548071  0.367200  0.520915  1
  Cu  Cu152  1  0.694243  0.413032  0.487453  1
  Cu  Cu153  1  0.871157  0.390117  0.504198  1
  Cu  Cu154  1  0.881404  0.033866  0.520915  1
  Cu  Cu155  1  0.027576  0.079698  0.487453  1
  Cu  Cu156  1  0.204490  0.056784  0.504198  1
  Cu  Cu157  1  0.714737  0.700533  0.520915  1
  Cu  Cu158  1  0.860910  0.746365  0.487453  1
  Cu  Cu159  1  0.037823  0.723451  0.504198  1
  Cu  Cu160  1  0.048071  0.367200  0.520915  1
  Cu  Cu161  1  0.194243  0.413032  0.487453  1
  Cu  Cu162  1  0.214737  0.700533  0.520915  1
  Cu  Cu163  1  0.418748  0.571769  0.493245  1
  Cu  Cu164  1  0.428995  0.215521  0.509990  1
  Cu  Cu165  1  0.575167  0.261353  0.476528  1
  Cu  Cu166  1  0.752081  0.238435  0.493245  1
  Cu  Cu167  1  0.408500  0.928020  0.476528  1
  Cu  Cu168  1  0.585414  0.905102  0.493245  1
  Cu  Cu169  1  0.595661  0.548854  0.509990  1
  Cu  Cu170  1  0.741834  0.594686  0.476528  1
  Cu  Cu171  1  0.918748  0.571769  0.493245  1
  Cu  Cu172  1  0.928995  0.215521  0.509990  1
  Cu  Cu173  1  0.075167  0.261353  0.476528  1
  Cu  Cu174  1  0.252081  0.238435  0.493245  1
  Cu  Cu175  1  0.762328  0.882187  0.509990  1
  Cu  Cu176  1  0.908500  0.928020  0.476528  1
  Cu  Cu177  1  0.085414  0.905102  0.493245  1
  Cu  Cu178  1  0.095661  0.548854  0.509990  1
  Cu  Cu179  1  0.241834  0.594686  0.476528  1
  Cu  Cu180  1  0.262328  0.882187  0.509990  1
  Cu  Cu181  1  0.401896  0.321380  0.554394  1
  Cu  Cu182  1  0.412111  0.965095  0.571080  1
  Cu  Cu183  1  0.558311  0.010931  0.537642  1
  Cu  Cu184  1  0.735229  0.988047  0.554394  1
  Cu  Cu185  1  0.391645  0.677598  0.537642  1
  Cu  Cu186  1  0.568562  0.654713  0.554394  1
  Cu  Cu187  1  0.578778  0.298429  0.571080  1
  Cu  Cu188  1  0.724978  0.344264  0.537642  1
  Cu  Cu189  1  0.901896  0.321380  0.554394  1
  Cu  Cu190  1  0.912111  0.965095  0.571080  1
  Cu  Cu191  1  0.058311  0.010931  0.537642  1
  Cu  Cu192  1  0.235229  0.988047  0.554394  1
  Cu  Cu193  1  0.745445  0.631762  0.571080  1
  Cu  Cu194  1  0.891645  0.677598  0.537642  1
  Cu  Cu195  1  0.068562  0.654713  0.554394  1
  Cu  Cu196  1  0.078778  0.298429  0.571080  1
  Cu  Cu197  1  0.224978  0.344264  0.537642  1
  Cu  Cu198  1  0.245445  0.631762  0.571080  1
  Cu  Cu199  1  0.449506  0.502996  0.543446  1
  Cu  Cu200  1  0.459713  0.146746  0.560177  1
  Cu  Cu201  1  0.605912  0.192579  0.526705  1
  Cu  Cu202  1  0.782839  0.169663  0.543446  1
  Cu  Cu203  1  0.439246  0.859246  0.526705  1
  Cu  Cu204  1  0.616173  0.836329  0.543446  1
  Cu  Cu205  1  0.626380  0.480079  0.560177  1
  Cu  Cu206  1  0.772579  0.525912  0.526705  1
  Cu  Cu207  1  0.949506  0.502996  0.543446  1
  Cu  Cu208  1  0.959713  0.146746  0.560177  1
  Cu  Cu209  1  0.105912  0.192579  0.526705  1
  Cu  Cu210  1  0.282839  0.169663  0.543446  1
  Cu  Cu211  1  0.793046  0.813412  0.560177  1
  Cu  Cu212  1  0.939246  0.859246  0.526705  1
  Cu  Cu213  1  0.116173  0.836329  0.543446  1
  Cu  Cu214  1  0.126380  0.480079  0.560177  1
  Cu  Cu215  1  0.272579  0.525912  0.526705  1
  Cu  Cu216  1  0.293046  0.813412  0.560177  1
  Cu  Cu217  1  0.432468  0.252668  0.604558  1
  Cu  Cu218  1  0.442507  0.896498  0.621238  1
  Cu  Cu219  1  0.588970  0.942109  0.587828  1
  Cu  Cu220  1  0.765801  0.919335  0.604558  1
  Cu  Cu221  1  0.422304  0.608775  0.587828  1
  Cu  Cu222  1  0.599135  0.586002  0.604558  1
  Cu  Cu223  1  0.609174  0.229831  0.621238  1
  Cu  Cu224  1  0.755637  0.275442  0.587828  1
  Cu  Cu225  1  0.932468  0.252668  0.604558  1
  Cu  Cu226  1  0.942507  0.896498  0.621238  1
  Cu  Cu227  1  0.088970  0.942109  0.587828  1
  Cu  Cu228  1  0.265801  0.919335  0.604558  1
  Cu  Cu229  1  0.775841  0.563165  0.621238  1
  Cu  Cu230  1  0.922304  0.608775  0.587828  1
  Cu  Cu231  1  0.099135  0.586002  0.604558  1
  Cu  Cu232  1  0.109174  0.229831  0.621238  1
  Cu  Cu233  1  0.255637  0.275442  0.587828  1
  Cu  Cu234  1  0.275841  0.563165  0.621238  1
  Cu  Cu235  1  0.480311  0.434240  0.593692  1
  Cu  Cu236  1  0.490495  0.077932  0.610351  1
  Cu  Cu237  1  0.636657  0.123794  0.576883  1
  Cu  Cu238  1  0.813644  0.100906  0.593692  1
  Cu  Cu239  1  0.469990  0.790461  0.576883  1
  Cu  Cu240  1  0.646978  0.767573  0.593692  1
  Cu  Cu241  1  0.657161  0.411266  0.610351  1
  Cu  Cu242  1  0.803324  0.457128  0.576883  1
  Cu  Cu243  1  0.980311  0.434240  0.593692  1
  Cu  Cu244  1  0.990495  0.077932  0.610351  1
  Cu  Cu245  1  0.136657  0.123794  0.576883  1
  Cu  Cu246  1  0.313644  0.100906  0.593692  1
  Cu  Cu247  1  0.823828  0.744599  0.610351  1
  Cu  Cu248  1  0.969990  0.790461  0.576883  1
  Cu  Cu249  1  0.146978  0.767573  0.593692  1
  Cu  Cu250  1  0.157161  0.411266  0.610351  1
  Cu  Cu251  1  0.303324  0.457128  0.576883  1
  Cu  Cu252  1  0.323828  0.744599  0.610351  1
  Cu  Cu253  1  0.462263  0.184061  0.654492  1
  Cu  Cu254  1  0.472516  0.827772  0.670849  1
  Cu  Cu255  1  0.619272  0.873552  0.638107  1
  Cu  Cu256  1  0.795597  0.850728  0.654492  1
  Cu  Cu257  1  0.452605  0.540219  0.638107  1
  Cu  Cu258  1  0.628930  0.517394  0.654492  1
  Cu  Cu259  1  0.639183  0.161105  0.670849  1
  Cu  Cu260  1  0.785938  0.206886  0.638107  1
  Cu  Cu261  1  0.962263  0.184061  0.654492  1
  Cu  Cu262  1  0.972516  0.827772  0.670849  1
  Cu  Cu263  1  0.119272  0.873552  0.638107  1
  Cu  Cu264  1  0.295597  0.850728  0.654492  1
  Cu  Cu265  1  0.805850  0.494439  0.670849  1
  Cu  Cu266  1  0.952605  0.540219  0.638107  1
  Cu  Cu267  1  0.128930  0.517394  0.654492  1
  Cu  Cu268  1  0.139183  0.161105  0.670849  1
  Cu  Cu269  1  0.285938  0.206886  0.638107  1
  Cu  Cu270  1  0.305850  0.494439  0.670849  1
  Cu  Cu271  1  0.510902  0.365573  0.644001  1
  Cu  Cu272  1  0.521324  0.009678  0.660462  1
  Cu  Cu273  1  0.667601  0.054852  0.627047  1
  Cu  Cu274  1  0.844236  0.032240  0.644001  1
  Cu  Cu275  1  0.500934  0.721519  0.627047  1
  Cu  Cu276  1  0.677569  0.698907  0.644001  1
  Cu  Cu277  1  0.687991  0.343011  0.660462  1
  Cu  Cu278  1  0.834268  0.388186  0.627047  1
  Cu  Cu279  1  0.010902  0.365573  0.644001  1
  Cu  Cu280  1  0.021324  0.009678  0.660462  1
  Cu  Cu281  1  0.167601  0.054852  0.627047  1
  Cu  Cu282  1  0.344236  0.032240  0.644001  1
  Cu  Cu283  1  0.854658  0.676345  0.660462  1
  Cu  Cu284  1  1.000934  0.721519  0.627047  1
  Cu  Cu285  1  0.177569  0.698907  0.644001  1
  Cu  Cu286  1  0.187991  0.343011  0.660462  1
  Cu  Cu287  1  0.334268  0.388186  0.627047  1
  Cu  Cu288  1  0.354658  0.676345  0.660462  1
  Cu  Cu289  1  0.491452  0.115901  0.703318  1
  Cu  Cu290  1  0.498647  0.761789  0.718672  1
  Cu  Cu291  1  0.649373  0.804666  0.687823  1
  Cu  Cu292  1  0.824785  0.782568  0.703318  1
  Cu  Cu293  1  0.482706  0.471333  0.687823  1
  Cu  Cu294  1  0.658119  0.449234  0.703318  1
  Cu  Cu295  1  0.665313  0.095122  0.718672  1
  Cu  Cu296  1  0.816039  0.138000  0.687823  1
  Cu  Cu297  1  0.991452  0.115901  0.703318  1
  Cu  Cu298  1  0.998647  0.761789  0.718672  1
  Cu  Cu299  1  0.149373  0.804666  0.687823  1
  Cu  Cu300  1  0.324785  0.782568  0.703318  1
  Cu  Cu301  1  0.831980  0.428456  0.718672  1
  Cu  Cu302  1  0.982706  0.471333  0.687823  1
  Cu  Cu303  1  0.158119  0.449234  0.703318  1
  Cu  Cu304  1  0.165313  0.095122  0.718672  1
  Cu  Cu305  1  0.316039  0.138000  0.687823  1
  Cu  Cu306  1  0.331980  0.428456  0.718672  1
  Cu  Cu307  1  0.541489  0.296339  0.693465  1
  Cu  Cu308  1  0.551291  0.941851  0.708892  1
  Cu  Cu309  1  0.698413  0.985634  0.677211  1
  Cu  Cu310  1  0.874823  0.963006  0.693465  1
  Cu  Cu311  1  0.531747  0.652301  0.677211  1
  Cu  Cu312  1  0.708156  0.629672  0.693465  1
  Cu  Cu313  1  0.717958  0.275185  0.708892  1
  Cu  Cu314  1  0.865080  0.318967  0.677211  1
  Cu  Cu315  1  0.041489  0.296339  0.693465  1
  Cu  Cu316  1  0.051291  0.941851  0.708892  1
  Cu  Cu317  1  0.198413  0.985634  0.677211  1
  Cu  Cu318  1  0.374823  0.963006  0.693465  1
  Cu  Cu319  1  0.884624  0.608518  0.708892  1
  Cu  Cu320  1  0.031747  0.652301  0.677211  1
  Cu  Cu321  1  0.208156  0.629672  0.693465  1
  Cu  Cu322  1  0.217958  0.275185  0.708892  1
  Cu  Cu323  1  0.365080  0.318967  0.677211  1
  Cu  Cu324  1  0.384624  0.608518  0.708892  1
