# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   13.43155899
_cell_length_b   13.25448994
_cell_length_c   46.91564966
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   94.14158641
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu
_chemical_formula_sum   Cu324
_cell_volume   8330.50998702
_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  0.257688  0.800270  0.319254  1
  Cu  Cu2  1  0.239008  0.516205  0.285153  1
  Cu  Cu3  1  0.417742  0.487708  0.299865  1
  Cu  Cu4  1  0.591021  0.466937  0.319254  1
  Cu  Cu5  1  0.251076  0.154375  0.299865  1
  Cu  Cu6  1  0.424354  0.133604  0.319254  1
  Cu  Cu7  1  0.405674  0.849538  0.285153  1
  Cu  Cu8  1  0.584409  0.821041  0.299865  1
  Cu  Cu9  1  0.757688  0.800270  0.319254  1
  Cu  Cu10  1  0.739008  0.516205  0.285153  1
  Cu  Cu11  1  0.917742  0.487708  0.299865  1
  Cu  Cu12  1  0.091021  0.466937  0.319254  1
  Cu  Cu13  1  0.572341  0.182872  0.285153  1
  Cu  Cu14  1  0.751076  0.154375  0.299865  1
  Cu  Cu15  1  0.924354  0.133604  0.319254  1
  Cu  Cu16  1  0.905674  0.849538  0.285153  1
  Cu  Cu17  1  0.084409  0.821041  0.299865  1
  Cu  Cu18  1  0.072341  0.182872  0.285153  1
  Cu  Cu19  1  0.282085  0.703304  0.276610  1
  Cu  Cu20  1  0.294077  0.335641  0.289869  1
  Cu  Cu21  1  0.469436  0.312305  0.306889  1
  Cu  Cu22  1  0.615418  0.369971  0.276610  1
  Cu  Cu23  1  0.302769  0.978971  0.306889  1
  Cu  Cu24  1  0.448751  0.036637  0.276610  1
  Cu  Cu25  1  0.460744  0.668974  0.289869  1
  Cu  Cu26  1  0.636103  0.645638  0.306889  1
  Cu  Cu27  1  0.782085  0.703304  0.276610  1
  Cu  Cu28  1  0.794077  0.335641  0.289869  1
  Cu  Cu29  1  0.969436  0.312305  0.306889  1
  Cu  Cu30  1  0.115418  0.369971  0.276610  1
  Cu  Cu31  1  0.627411  1.002308  0.289869  1
  Cu  Cu32  1  0.802769  0.978971  0.306889  1
  Cu  Cu33  1  0.948751  0.036637  0.276610  1
  Cu  Cu34  1  0.960744  0.668974  0.289869  1
  Cu  Cu35  1  0.136103  0.645638  0.306889  1
  Cu  Cu36  1  0.127411  1.002308  0.289869  1
  Cu  Cu37  1  0.288915  0.728635  0.368211  1
  Cu  Cu38  1  0.269019  0.442253  0.334304  1
  Cu  Cu39  1  0.444201  0.418159  0.351213  1
  Cu  Cu40  1  0.622248  0.395302  0.368211  1
  Cu  Cu41  1  0.277534  0.084826  0.351213  1
  Cu  Cu42  1  0.455582  0.061969  0.368211  1
  Cu  Cu43  1  0.435686  0.775587  0.334304  1
  Cu  Cu44  1  0.610867  0.751492  0.351213  1
  Cu  Cu45  1  0.788915  0.728635  0.368211  1
  Cu  Cu46  1  0.769019  0.442253  0.334304  1
  Cu  Cu47  1  0.944201  0.418159  0.351213  1
  Cu  Cu48  1  0.122248  0.395302  0.368211  1
  Cu  Cu49  1  0.602353  0.108920  0.334304  1
  Cu  Cu50  1  0.777534  0.084826  0.351213  1
  Cu  Cu51  1  0.955582  0.061969  0.368211  1
  Cu  Cu52  1  0.935686  0.775587  0.334304  1
  Cu  Cu53  1  0.110867  0.751492  0.351213  1
  Cu  Cu54  1  0.102353  0.108920  0.334304  1
  Cu  Cu55  1  0.316447  0.624281  0.324328  1
  Cu  Cu56  1  0.324692  0.267226  0.340550  1
  Cu  Cu57  1  0.503492  0.244578  0.357174  1
  Cu  Cu58  1  0.649780  0.290948  0.324328  1
  Cu  Cu59  1  0.336825  0.911245  0.357174  1
  Cu  Cu60  1  0.483114  0.957615  0.324328  1
  Cu  Cu61  1  0.491359  0.600559  0.340550  1
  Cu  Cu62  1  0.670159  0.577911  0.357174  1
  Cu  Cu63  1  0.816447  0.624281  0.324328  1
  Cu  Cu64  1  0.824692  0.267226  0.340550  1
  Cu  Cu65  1  1.003492  0.244578  0.357174  1
  Cu  Cu66  1  0.149780  0.290948  0.324328  1
  Cu  Cu67  1  0.658025  0.933892  0.340550  1
  Cu  Cu68  1  0.836825  0.911245  0.357174  1
  Cu  Cu69  1  0.983114  0.957615  0.324328  1
  Cu  Cu70  1  0.991359  0.600559  0.340550  1
  Cu  Cu71  1  0.170159  0.577911  0.357174  1
  Cu  Cu72  1  0.158025  0.933892  0.340550  1
  Cu  Cu73  1  0.319136  0.657440  0.418172  1
  Cu  Cu74  1  0.298594  0.371189  0.384702  1
  Cu  Cu75  1  0.475451  0.347763  0.401417  1
  Cu  Cu76  1  0.652470  0.324106  0.418172  1
  Cu  Cu77  1  0.308784  0.014430  0.401417  1
  Cu  Cu78  1  0.485803  0.990773  0.418172  1
  Cu  Cu79  1  0.465261  0.704523  0.384702  1
  Cu  Cu80  1  0.642118  0.681097  0.401417  1
  Cu  Cu81  1  0.819136  0.657440  0.418172  1
  Cu  Cu82  1  0.798594  0.371189  0.384702  1
  Cu  Cu83  1  0.975451  0.347763  0.401417  1
  Cu  Cu84  1  0.152470  0.324106  0.418172  1
  Cu  Cu85  1  0.631928  0.037856  0.384702  1
  Cu  Cu86  1  0.808784  0.014430  0.401417  1
  Cu  Cu87  1  0.985803  0.990773  0.418172  1
  Cu  Cu88  1  0.965261  0.704523  0.384702  1
  Cu  Cu89  1  0.142118  0.681097  0.401417  1
  Cu  Cu90  1  0.131928  0.037856  0.384702  1
  Cu  Cu91  1  0.346229  0.552986  0.373902  1
  Cu  Cu92  1  0.356673  0.196413  0.390367  1
  Cu  Cu93  1  0.533533  0.173032  0.407229  1
  Cu  Cu94  1  0.679562  0.219652  0.373902  1
  Cu  Cu95  1  0.366866  0.839699  0.407229  1
  Cu  Cu96  1  0.512896  0.886319  0.373902  1
  Cu  Cu97  1  0.523340  0.529746  0.390367  1
  Cu  Cu98  1  0.700199  0.506366  0.407229  1
  Cu  Cu99  1  0.846229  0.552986  0.373902  1
  Cu  Cu100  1  0.856673  0.196413  0.390367  1
  Cu  Cu101  1  0.033533  0.173032  0.407229  1
  Cu  Cu102  1  0.179562  0.219652  0.373902  1
  Cu  Cu103  1  0.690007  0.863079  0.390367  1
  Cu  Cu104  1  0.866866  0.839699  0.407229  1
  Cu  Cu105  1  0.012896  0.886319  0.373902  1
  Cu  Cu106  1  0.023340  0.529746  0.390367  1
  Cu  Cu107  1  0.200199  0.506366  0.407229  1
  Cu  Cu108  1  0.190007  0.863079  0.390367  1
  Cu  Cu109  1  0.349847  0.586627  0.468217  1
  Cu  Cu110  1  0.329360  0.300404  0.434794  1
  Cu  Cu111  1  0.506233  0.276931  0.451531  1
  Cu  Cu112  1  0.683181  0.253293  0.468217  1
  Cu  Cu113  1  0.339566  0.943597  0.451531  1
  Cu  Cu114  1  0.516514  0.919960  0.468217  1
  Cu  Cu115  1  0.496026  0.633737  0.434794  1
  Cu  Cu116  1  0.672899  0.610264  0.451531  1
  Cu  Cu117  1  0.849847  0.586627  0.468217  1
  Cu  Cu118  1  0.829360  0.300404  0.434794  1
  Cu  Cu119  1  0.006233  0.276931  0.451531  1
  Cu  Cu120  1  0.183181  0.253293  0.468217  1
  Cu  Cu121  1  0.662693  0.967071  0.434794  1
  Cu  Cu122  1  0.839566  0.943597  0.451531  1
  Cu  Cu123  1  0.016514  0.919960  0.468217  1
  Cu  Cu124  1  0.996026  0.633737  0.434794  1
  Cu  Cu125  1  0.172899  0.610264  0.451531  1
  Cu  Cu126  1  0.162693  0.967071  0.434794  1
  Cu  Cu127  1  0.377130  0.482572  0.423868  1
  Cu  Cu128  1  0.387327  0.125737  0.440524  1
  Cu  Cu129  1  0.564268  0.102135  0.457253  1
  Cu  Cu130  1  0.710463  0.149239  0.423868  1
  Cu  Cu131  1  0.397601  0.768802  0.457253  1
  Cu  Cu132  1  0.543796  0.815905  0.423868  1
  Cu  Cu133  1  0.553994  0.459070  0.440524  1
  Cu  Cu134  1  0.730934  0.435469  0.457253  1
  Cu  Cu135  1  0.877130  0.482572  0.423868  1
  Cu  Cu136  1  0.887327  0.125737  0.440524  1
  Cu  Cu137  1  0.064268  0.102135  0.457253  1
  Cu  Cu138  1  0.210463  0.149239  0.423868  1
  Cu  Cu139  1  0.720661  0.792403  0.440524  1
  Cu  Cu140  1  0.897601  0.768802  0.457253  1
  Cu  Cu141  1  0.043796  0.815905  0.423868  1
  Cu  Cu142  1  0.053994  0.459070  0.440524  1
  Cu  Cu143  1  0.230934  0.435469  0.457253  1
  Cu  Cu144  1  0.220661  0.792403  0.440524  1
  Cu  Cu145  1  0.380571  0.515872  0.518285  1
  Cu  Cu146  1  0.360064  0.229695  0.484890  1
  Cu  Cu147  1  0.536979  0.206110  0.501600  1
  Cu  Cu148  1  0.713904  0.182539  0.518285  1
  Cu  Cu149  1  0.370313  0.872777  0.501600  1
  Cu  Cu150  1  0.547237  0.849206  0.518285  1
  Cu  Cu151  1  0.526731  0.563028  0.484890  1
  Cu  Cu152  1  0.703646  0.539444  0.501600  1
  Cu  Cu153  1  0.880571  0.515872  0.518285  1
  Cu  Cu154  1  0.860064  0.229695  0.484890  1
  Cu  Cu155  1  0.036979  0.206110  0.501600  1
  Cu  Cu156  1  0.213904  0.182539  0.518285  1
  Cu  Cu157  1  0.693397  0.896362  0.484890  1
  Cu  Cu158  1  0.870313  0.872777  0.501600  1
  Cu  Cu159  1  0.047237  0.849206  0.518285  1
  Cu  Cu160  1  0.026731  0.563028  0.484890  1
  Cu  Cu161  1  0.203646  0.539444  0.501600  1
  Cu  Cu162  1  0.193397  0.896362  0.484890  1
  Cu  Cu163  1  0.407811  0.411860  0.473924  1
  Cu  Cu164  1  0.418070  0.054956  0.490610  1
  Cu  Cu165  1  0.594985  0.031371  0.507319  1
  Cu  Cu166  1  0.741145  0.078527  0.473924  1
  Cu  Cu167  1  0.428318  0.698037  0.507319  1
  Cu  Cu168  1  0.574478  0.745193  0.473924  1
  Cu  Cu169  1  0.584736  0.388289  0.490610  1
  Cu  Cu170  1  0.761652  0.364704  0.507319  1
  Cu  Cu171  1  0.907811  0.411860  0.473924  1
  Cu  Cu172  1  0.918070  0.054956  0.490610  1
  Cu  Cu173  1  0.094985  0.031371  0.507319  1
  Cu  Cu174  1  0.241145  0.078527  0.473924  1
  Cu  Cu175  1  0.751403  0.721622  0.490610  1
  Cu  Cu176  1  0.928318  0.698037  0.507319  1
  Cu  Cu177  1  0.074478  0.745193  0.473924  1
  Cu  Cu178  1  0.084736  0.388289  0.490610  1
  Cu  Cu179  1  0.261652  0.364704  0.507319  1
  Cu  Cu180  1  0.251403  0.721622  0.490610  1
  Cu  Cu181  1  0.411252  0.445160  0.568341  1
  Cu  Cu182  1  0.390781  0.158930  0.534956  1
  Cu  Cu183  1  0.567721  0.135329  0.551685  1
  Cu  Cu184  1  0.744586  0.111827  0.568341  1
  Cu  Cu185  1  0.401055  0.801996  0.551685  1
  Cu  Cu186  1  0.577919  0.778494  0.568341  1
  Cu  Cu187  1  0.557448  0.492264  0.534956  1
  Cu  Cu188  1  0.734388  0.468663  0.551685  1
  Cu  Cu189  1  0.911252  0.445160  0.568341  1
  Cu  Cu190  1  0.890781  0.158930  0.534956  1
  Cu  Cu191  1  0.067721  0.135329  0.551685  1
  Cu  Cu192  1  0.244586  0.111827  0.568341  1
  Cu  Cu193  1  0.724114  0.825597  0.534956  1
  Cu  Cu194  1  0.901055  0.801996  0.551685  1
  Cu  Cu195  1  0.077919  0.778494  0.568341  1
  Cu  Cu196  1  0.057448  0.492264  0.534956  1
  Cu  Cu197  1  0.234388  0.468663  0.551685  1
  Cu  Cu198  1  0.224114  0.825597  0.534956  1
  Cu  Cu199  1  0.438535  0.341106  0.523992  1
  Cu  Cu200  1  0.448816  0.984135  0.540678  1
  Cu  Cu201  1  0.625689  0.960662  0.557415  1
  Cu  Cu202  1  0.771868  0.007772  0.523992  1
  Cu  Cu203  1  0.459023  0.627328  0.557415  1
  Cu  Cu204  1  0.605201  0.674439  0.523992  1
  Cu  Cu205  1  0.615483  0.317468  0.540678  1
  Cu  Cu206  1  0.792356  0.293995  0.557415  1
  Cu  Cu207  1  0.938535  0.341106  0.523992  1
  Cu  Cu208  1  0.948816  0.984135  0.540678  1
  Cu  Cu209  1  0.125689  0.960662  0.557415  1
  Cu  Cu210  1  0.271868  0.007772  0.523992  1
  Cu  Cu211  1  0.782150  0.650802  0.540678  1
  Cu  Cu212  1  0.959023  0.627328  0.557415  1
  Cu  Cu213  1  0.105201  0.674439  0.523992  1
  Cu  Cu214  1  0.115483  0.317468  0.540678  1
  Cu  Cu215  1  0.292356  0.293995  0.557415  1
  Cu  Cu216  1  0.282150  0.650802  0.540678  1
  Cu  Cu217  1  0.442153  0.374747  0.618307  1
  Cu  Cu218  1  0.421516  0.088033  0.584981  1
  Cu  Cu219  1  0.598375  0.064653  0.601842  1
  Cu  Cu220  1  0.775487  0.041413  0.618307  1
  Cu  Cu221  1  0.431709  0.731320  0.601842  1
  Cu  Cu222  1  0.608820  0.708080  0.618307  1
  Cu  Cu223  1  0.588183  0.421367  0.584981  1
  Cu  Cu224  1  0.765042  0.397987  0.601842  1
  Cu  Cu225  1  0.942153  0.374747  0.618307  1
  Cu  Cu226  1  0.921516  0.088033  0.584981  1
  Cu  Cu227  1  0.098375  0.064653  0.601842  1
  Cu  Cu228  1  0.275487  0.041413  0.618307  1
  Cu  Cu229  1  0.754850  0.754700  0.584981  1
  Cu  Cu230  1  0.931709  0.731320  0.601842  1
  Cu  Cu231  1  0.108820  0.708080  0.618307  1
  Cu  Cu232  1  0.088183  0.421367  0.584981  1
  Cu  Cu233  1  0.265042  0.397987  0.601842  1
  Cu  Cu234  1  0.254850  0.754700  0.584981  1
  Cu  Cu235  1  0.469246  0.270293  0.574037  1
  Cu  Cu236  1  0.479598  0.913302  0.590792  1
  Cu  Cu237  1  0.656455  0.889876  0.607507  1
  Cu  Cu238  1  0.802579  0.936959  0.574037  1
  Cu  Cu239  1  0.489788  0.556543  0.607507  1
  Cu  Cu240  1  0.635913  0.603626  0.574037  1
  Cu  Cu241  1  0.646265  0.246636  0.590792  1
  Cu  Cu242  1  0.823121  0.223210  0.607507  1
  Cu  Cu243  1  0.969246  0.270293  0.574037  1
  Cu  Cu244  1  0.979598  0.913302  0.590792  1
  Cu  Cu245  1  0.156455  0.889876  0.607507  1
  Cu  Cu246  1  0.302579  0.936959  0.574037  1
  Cu  Cu247  1  0.812931  0.579969  0.590792  1
  Cu  Cu248  1  0.989788  0.556543  0.607507  1
  Cu  Cu249  1  0.135913  0.603626  0.574037  1
  Cu  Cu250  1  0.146265  0.246636  0.590792  1
  Cu  Cu251  1  0.323121  0.223210  0.607507  1
  Cu  Cu252  1  0.312931  0.579969  0.590792  1
  Cu  Cu253  1  0.471935  0.303451  0.667882  1
  Cu  Cu254  1  0.451557  0.016488  0.635036  1
  Cu  Cu255  1  0.630357  0.993840  0.651659  1
  Cu  Cu256  1  0.805269  0.970118  0.667882  1
  Cu  Cu257  1  0.463690  0.660507  0.651659  1
  Cu  Cu258  1  0.638602  0.636784  0.667882  1
  Cu  Cu259  1  0.618223  0.349821  0.635036  1
  Cu  Cu260  1  0.797024  0.327174  0.651659  1
  Cu  Cu261  1  0.971935  0.303451  0.667882  1
  Cu  Cu262  1  0.951557  0.016488  0.635036  1
  Cu  Cu263  1  0.130357  0.993840  0.651659  1
  Cu  Cu264  1  0.305269  0.970118  0.667882  1
  Cu  Cu265  1  0.784890  0.683154  0.635036  1
  Cu  Cu266  1  0.963690  0.660507  0.651659  1
  Cu  Cu267  1  0.138602  0.636784  0.667882  1
  Cu  Cu268  1  0.118223  0.349821  0.635036  1
  Cu  Cu269  1  0.297024  0.327174  0.651659  1
  Cu  Cu270  1  0.284890  0.683154  0.635036  1
  Cu  Cu271  1  0.499467  0.199097  0.623998  1
  Cu  Cu272  1  0.510848  0.842907  0.640997  1
  Cu  Cu273  1  0.686030  0.818812  0.657906  1
  Cu  Cu274  1  0.832800  0.865764  0.623998  1
  Cu  Cu275  1  0.519363  0.485479  0.657906  1
  Cu  Cu276  1  0.666134  0.532430  0.623998  1
  Cu  Cu277  1  0.677515  0.176240  0.640997  1
  Cu  Cu278  1  0.852696  0.152146  0.657906  1
  Cu  Cu279  1  0.999467  0.199097  0.623998  1
  Cu  Cu280  1  0.010848  0.842907  0.640997  1
  Cu  Cu281  1  0.186030  0.818812  0.657906  1
  Cu  Cu282  1  0.332800  0.865764  0.623998  1
  Cu  Cu283  1  0.844182  0.509573  0.640997  1
  Cu  Cu284  1  0.019363  0.485479  0.657906  1
  Cu  Cu285  1  0.166134  0.532430  0.623998  1
  Cu  Cu286  1  0.177515  0.176240  0.640997  1
  Cu  Cu287  1  0.352696  0.152146  0.657906  1
  Cu  Cu288  1  0.344182  0.509573  0.640997  1
  Cu  Cu289  1  0.506297  0.224428  0.715600  1
  Cu  Cu290  1  0.485613  0.948761  0.685320  1
  Cu  Cu291  1  0.660972  0.925425  0.702340  1
  Cu  Cu292  1  0.839631  0.891095  0.715600  1
  Cu  Cu293  1  0.494305  0.592092  0.702340  1
  Cu  Cu294  1  0.672964  0.557762  0.715600  1
  Cu  Cu295  1  0.652280  0.282094  0.685320  1
  Cu  Cu296  1  0.827638  0.258758  0.702340  1
  Cu  Cu297  1  0.006297  0.224428  0.715600  1
  Cu  Cu298  1  0.985613  0.948761  0.685320  1
  Cu  Cu299  1  0.160972  0.925425  0.702340  1
  Cu  Cu300  1  0.339631  0.891095  0.715600  1
  Cu  Cu301  1  0.818946  0.615428  0.685320  1
  Cu  Cu302  1  0.994305  0.592092  0.702340  1
  Cu  Cu303  1  0.172964  0.557762  0.715600  1
  Cu  Cu304  1  0.152280  0.282094  0.685320  1
  Cu  Cu305  1  0.327638  0.258758  0.702340  1
  Cu  Cu306  1  0.318946  0.615428  0.685320  1
  Cu  Cu307  1  0.530695  0.127462  0.672956  1
  Cu  Cu308  1  0.537307  0.773358  0.692344  1
  Cu  Cu309  1  0.716041  0.744861  0.707056  1
  Cu  Cu310  1  0.864028  0.794129  0.672956  1
  Cu  Cu311  1  0.549374  0.411528  0.707056  1
  Cu  Cu312  1  0.697361  0.460795  0.672956  1
  Cu  Cu313  1  0.703973  0.106691  0.692344  1
  Cu  Cu314  1  0.882708  0.078194  0.707056  1
  Cu  Cu315  1  0.030695  0.127462  0.672956  1
  Cu  Cu316  1  0.037307  0.773358  0.692344  1
  Cu  Cu317  1  0.216041  0.744861  0.707056  1
  Cu  Cu318  1  0.364028  0.794129  0.672956  1
  Cu  Cu319  1  0.870640  0.440024  0.692344  1
  Cu  Cu320  1  0.049374  0.411528  0.707056  1
  Cu  Cu321  1  0.197361  0.460795  0.672956  1
  Cu  Cu322  1  0.203973  0.106691  0.692344  1
  Cu  Cu323  1  0.382708  0.078194  0.707056  1
  Cu  Cu324  1  0.370640  0.440024  0.692344  1
