# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.38845941
_cell_length_b   17.79500914
_cell_length_c   46.22829947
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   79.89738821
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu
_chemical_formula_sum   Cu324
_cell_volume   8413.38720771
_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  0.136239  0.726889  0.300375  1
  Cu  Cu2  1  0.628413  0.484693  0.288726  1
  Cu  Cu3  1  0.752263  0.707056  0.309418  1
  Cu  Cu4  1  0.956852  0.173018  0.325875  1
  Cu  Cu5  1  0.065984  0.355375  0.270715  1
  Cu  Cu6  1  0.017213  0.500762  0.278887  1
  Cu  Cu7  1  0.455855  0.371014  0.260525  1
  Cu  Cu8  1  0.405292  0.517815  0.269752  1
  Cu  Cu9  1  0.351998  0.668180  0.279570  1
  Cu  Cu10  1  0.621461  0.013694  0.326893  1
  Cu  Cu11  1  0.721113  0.199613  0.276143  1
  Cu  Cu12  1  0.676323  0.343140  0.282649  1
  Cu  Cu13  1  0.072292  0.875673  0.309043  1
  Cu  Cu14  1  0.010721  0.025154  0.317380  1
  Cu  Cu15  1  0.458276  0.903976  0.301935  1
  Cu  Cu16  1  0.393239  0.043732  0.306940  1
  Cu  Cu17  1  0.346926  0.186461  0.314123  1
  Cu  Cu18  1  0.687952  0.856679  0.317134  1
  Cu  Cu19  1  0.964532  0.647970  0.287440  1
  Cu  Cu20  1  0.461489  0.417747  0.309712  1
  Cu  Cu21  1  0.581022  0.624859  0.293264  1
  Cu  Cu22  1  0.778697  0.099707  0.314350  1
  Cu  Cu23  1  0.905143  0.269629  0.285765  1
  Cu  Cu24  1  0.857480  0.414872  0.294255  1
  Cu  Cu25  1  0.294228  0.284338  0.273810  1
  Cu  Cu26  1  0.244853  0.430179  0.282416  1
  Cu  Cu27  1  0.193652  0.578207  0.291322  1
  Cu  Cu28  1  0.456840  0.954604  0.351868  1
  Cu  Cu29  1  0.554667  0.122082  0.289829  1
  Cu  Cu30  1  0.510392  0.267931  0.298822  1
  Cu  Cu31  1  0.904163  0.796542  0.296437  1
  Cu  Cu32  1  0.837721  0.947754  0.305981  1
  Cu  Cu33  1  0.290106  0.816416  0.287610  1
  Cu  Cu34  1  0.223445  0.963391  0.294663  1
  Cu  Cu35  1  0.164174  0.113282  0.301422  1
  Cu  Cu36  1  0.523123  0.764331  0.297405  1
  Cu  Cu37  1  0.966322  0.702872  0.337161  1
  Cu  Cu38  1  0.468826  0.469457  0.359329  1
  Cu  Cu39  1  0.582244  0.678469  0.343468  1
  Cu  Cu40  1  0.788530  0.153102  0.364936  1
  Cu  Cu41  1  0.912612  0.321684  0.335746  1
  Cu  Cu42  1  0.864345  0.468732  0.344560  1
  Cu  Cu43  1  0.300343  0.333927  0.323397  1
  Cu  Cu44  1  0.251038  0.482950  0.332406  1
  Cu  Cu45  1  0.197701  0.632277  0.341358  1
  Cu  Cu46  1  0.464195  1.006226  0.402094  1
  Cu  Cu47  1  0.569868  0.168971  0.339190  1
  Cu  Cu48  1  0.519455  0.318553  0.349238  1
  Cu  Cu49  1  0.903837  0.852239  0.345990  1
  Cu  Cu50  1  0.841636  1.003519  0.355269  1
  Cu  Cu51  1  0.288282  0.871152  0.336548  1
  Cu  Cu52  1  0.226523  0.018859  0.343748  1
  Cu  Cu53  1  0.175100  0.164966  0.351790  1
  Cu  Cu54  1  0.519378  0.816428  0.347569  1
  Cu  Cu55  1  0.808264  0.560235  0.302248  1
  Cu  Cu56  1  0.307970  0.385837  0.373722  1
  Cu  Cu57  1  0.410819  0.569167  0.319040  1
  Cu  Cu58  1  0.630566  0.067643  0.378317  1
  Cu  Cu59  1  0.730696  0.250792  0.324751  1
  Cu  Cu60  1  0.683807  0.396153  0.332454  1
  Cu  Cu61  1  0.120392  0.259797  0.310450  1
  Cu  Cu62  1  0.073393  0.407446  0.320125  1
  Cu  Cu63  1  0.022819  0.554945  0.328633  1
  Cu  Cu64  1  0.291044  0.923196  0.386819  1
  Cu  Cu65  1  0.405795  0.094537  0.356831  1
  Cu  Cu66  1  0.356841  0.238081  0.364627  1
  Cu  Cu67  1  0.752384  0.763454  0.359551  1
  Cu  Cu68  1  0.689041  0.914081  0.367390  1
  Cu  Cu69  1  0.137258  0.781803  0.350473  1
  Cu  Cu70  1  0.074335  0.931055  0.359118  1
  Cu  Cu71  1  0.017288  0.078994  0.367978  1
  Cu  Cu72  1  0.352944  0.721967  0.328680  1
  Cu  Cu73  1  0.812031  0.615637  0.352495  1
  Cu  Cu74  1  0.314137  0.438217  0.424242  1
  Cu  Cu75  1  0.414316  0.621435  0.369090  1
  Cu  Cu76  1  0.637723  0.121437  0.429694  1
  Cu  Cu77  1  0.739130  0.302517  0.374705  1
  Cu  Cu78  1  0.690129  0.448751  0.382841  1
  Cu  Cu79  1  0.128464  0.311944  0.361213  1
  Cu  Cu80  1  0.079815  0.460014  0.370437  1
  Cu  Cu81  1  0.027267  0.608047  0.378986  1
  Cu  Cu82  1  0.297535  0.975251  0.437250  1
  Cu  Cu83  1  0.413593  0.146249  0.407502  1
  Cu  Cu84  1  0.364330  0.290500  0.415316  1
  Cu  Cu85  1  0.756317  0.817477  0.410330  1
  Cu  Cu86  1  0.694692  0.967696  0.418781  1
  Cu  Cu87  1  0.140112  0.834882  0.401250  1
  Cu  Cu88  1  0.080080  0.983761  0.410084  1
  Cu  Cu89  1  0.024818  0.131682  0.418946  1
  Cu  Cu90  1  0.353871  0.774033  0.379016  1
  Cu  Cu91  1  0.635385  0.538811  0.338840  1
  Cu  Cu92  1  0.135329  0.364697  0.411942  1
  Cu  Cu93  1  0.256685  0.535186  0.382881  1
  Cu  Cu94  1  0.471362  0.057986  0.452470  1
  Cu  Cu95  1  0.577912  0.220597  0.389641  1
  Cu  Cu96  1  0.526548  0.370893  0.399682  1
  Cu  Cu97  1  0.967101  0.226492  0.376951  1
  Cu  Cu98  1  0.919330  0.374663  0.386412  1
  Cu  Cu99  1  0.869583  0.522152  0.395172  1
  Cu  Cu100  1  0.146200  0.887161  0.452015  1
  Cu  Cu101  1  0.234212  0.070811  0.394188  1
  Cu  Cu102  1  0.183631  0.217381  0.402749  1
  Cu  Cu103  1  0.585557  0.731212  0.394132  1
  Cu  Cu104  1  0.523970  0.868643  0.397996  1
  Cu  Cu105  1  0.968865  0.756575  0.387421  1
  Cu  Cu106  1  0.907249  0.906358  0.396250  1
  Cu  Cu107  1  0.848550  0.056431  0.406046  1
  Cu  Cu108  1  0.200870  0.684970  0.392025  1
  Cu  Cu109  1  0.639871  0.591704  0.389416  1
  Cu  Cu110  1  0.141420  0.417338  0.462553  1
  Cu  Cu111  1  0.261816  0.587512  0.433408  1
  Cu  Cu112  1  0.478287  0.109979  0.502846  1
  Cu  Cu113  1  0.584770  0.273277  0.440287  1
  Cu  Cu114  1  0.532737  0.423298  0.450159  1
  Cu  Cu115  1  0.974436  0.279660  0.427937  1
  Cu  Cu116  1  0.925211  0.427679  0.437055  1
  Cu  Cu117  1  0.874782  0.575099  0.445787  1
  Cu  Cu118  1  0.152891  0.939339  0.502739  1
  Cu  Cu119  1  0.241431  0.122873  0.444919  1
  Cu  Cu120  1  0.190773  0.269866  0.453565  1
  Cu  Cu121  1  0.590818  0.783547  0.444816  1
  Cu  Cu122  1  0.529562  0.920510  0.448568  1
  Cu  Cu123  1  0.973420  0.809477  0.437981  1
  Cu  Cu124  1  0.913343  0.958787  0.447051  1
  Cu  Cu125  1  0.855640  0.109102  0.456932  1
  Cu  Cu126  1  0.205881  0.737488  0.442673  1
  Cu  Cu127  1  0.474278  0.521408  0.409519  1
  Cu  Cu128  1  0.980888  0.332609  0.478715  1
  Cu  Cu129  1  0.085304  0.512713  0.420916  1
  Cu  Cu130  1  0.304405  0.027237  0.487770  1
  Cu  Cu131  1  0.420695  0.198411  0.458100  1
  Cu  Cu132  1  0.370806  0.343029  0.465954  1
  Cu  Cu133  1  0.796185  0.206204  0.415753  1
  Cu  Cu134  1  0.745804  0.355002  0.425074  1
  Cu  Cu135  1  0.695596  0.501376  0.433315  1
  Cu  Cu136  1  0.979663  0.861766  0.488688  1
  Cu  Cu137  1  0.086874  0.036022  0.460875  1
  Cu  Cu138  1  0.031726  0.184348  0.469720  1
  Cu  Cu139  1  0.418744  0.673327  0.419504  1
  Cu  Cu140  1  0.359008  0.826011  0.429439  1
  Cu  Cu141  1  0.815930  0.669389  0.403181  1
  Cu  Cu142  1  0.761857  0.870253  0.461243  1
  Cu  Cu143  1  0.701293  0.020849  0.469835  1
  Cu  Cu144  1  0.031806  0.660943  0.429509  1
  Cu  Cu145  1  0.479838  0.573487  0.459923  1
  Cu  Cu146  1  0.986976  0.385396  0.529444  1
  Cu  Cu147  1  0.090846  0.565349  0.471451  1
  Cu  Cu148  1  0.311080  0.079407  0.538249  1
  Cu  Cu149  1  0.427192  0.250712  0.508636  1
  Cu  Cu150  1  0.376982  0.395526  0.516574  1
  Cu  Cu151  1  0.802945  0.259053  0.466497  1
  Cu  Cu152  1  0.751960  0.407590  0.475577  1
  Cu  Cu153  1  0.701287  0.553918  0.483879  1
  Cu  Cu154  1  0.986495  0.913961  0.539403  1
  Cu  Cu155  1  0.093579  0.088361  0.511501  1
  Cu  Cu156  1  0.038055  0.236986  0.520354  1
  Cu  Cu157  1  0.424385  0.725433  0.470055  1
  Cu  Cu158  1  0.365158  0.877882  0.480010  1
  Cu  Cu159  1  0.821068  0.722290  0.453925  1
  Cu  Cu160  1  0.768388  0.922717  0.512020  1
  Cu  Cu161  1  0.707893  0.073588  0.520599  1
  Cu  Cu162  1  0.037408  0.713550  0.480132  1
  Cu  Cu163  1  0.320025  0.490625  0.474803  1
  Cu  Cu164  1  0.809235  0.311828  0.517232  1
  Cu  Cu165  1  0.931051  0.480451  0.487707  1
  Cu  Cu166  1  0.159647  0.991675  0.553391  1
  Cu  Cu167  1  0.248251  0.175149  0.495597  1
  Cu  Cu168  1  0.197181  0.322446  0.504265  1
  Cu  Cu169  1  0.644439  0.174783  0.480699  1
  Cu  Cu170  1  0.591081  0.326038  0.490975  1
  Cu  Cu171  1  0.538839  0.475674  0.500700  1
  Cu  Cu172  1  0.827183  0.774763  0.504756  1
  Cu  Cu173  1  0.920096  0.011109  0.497840  1
  Cu  Cu174  1  0.862303  0.161735  0.507739  1
  Cu  Cu175  1  0.267589  0.639816  0.483979  1
  Cu  Cu176  1  0.212064  0.789656  0.493425  1
  Cu  Cu177  1  0.644728  0.644317  0.440059  1
  Cu  Cu178  1  0.596841  0.835691  0.495529  1
  Cu  Cu179  1  0.536120  0.972497  0.499117  1
  Cu  Cu180  1  0.880603  0.627699  0.496471  1
  Cu  Cu181  1  0.326197  0.542962  0.525358  1
  Cu  Cu182  1  0.815216  0.364568  0.568069  1
  Cu  Cu183  1  0.937145  0.533044  0.538394  1
  Cu  Cu184  1  0.165715  0.044270  0.603968  1
  Cu  Cu185  1  0.254411  0.227630  0.546186  1
  Cu  Cu186  1  0.203166  0.375105  0.554922  1
  Cu  Cu187  1  0.650621  0.227784  0.531524  1
  Cu  Cu188  1  0.597217  0.378688  0.541701  1
  Cu  Cu189  1  0.545266  0.527995  0.551287  1
  Cu  Cu190  1  0.833959  0.827194  0.555628  1
  Cu  Cu191  1  0.926721  0.063413  0.548533  1
  Cu  Cu192  1  0.868192  0.214326  0.558474  1
  Cu  Cu193  1  0.274014  0.692019  0.534627  1
  Cu  Cu194  1  0.218835  0.841984  0.544225  1
  Cu  Cu195  1  0.650500  0.696748  0.490768  1
  Cu  Cu196  1  0.603537  0.887810  0.546158  1
  Cu  Cu197  1  0.542813  0.024622  0.549657  1
  Cu  Cu198  1  0.887142  0.680067  0.547246  1
  Cu  Cu199  1  0.147411  0.469924  0.513130  1
  Cu  Cu200  1  0.656164  0.280540  0.582314  1
  Cu  Cu201  1  0.758060  0.460140  0.526191  1
  Cu  Cu202  1  0.993317  0.966206  0.590073  1
  Cu  Cu203  1  0.099655  0.140795  0.562006  1
  Cu  Cu204  1  0.043675  0.289505  0.570888  1
  Cu  Cu205  1  0.484517  0.162109  0.553210  1
  Cu  Cu206  1  0.433165  0.303053  0.559122  1
  Cu  Cu207  1  0.383199  0.447991  0.567173  1
  Cu  Cu208  1  0.657034  0.749063  0.541570  1
  Cu  Cu209  1  0.775191  0.974998  0.562643  1
  Cu  Cu210  1  0.713833  0.125895  0.571134  1
  Cu  Cu211  1  0.096914  0.617921  0.522070  1
  Cu  Cu212  1  0.043851  0.765962  0.530909  1
  Cu  Cu213  1  0.485892  0.625683  0.510459  1
  Cu  Cu214  1  0.430768  0.777665  0.520829  1
  Cu  Cu215  1  0.371917  0.929982  0.530637  1
  Cu  Cu216  1  0.707461  0.606400  0.534545  1
  Cu  Cu217  1  0.153618  0.522501  0.563687  1
  Cu  Cu218  1  0.660744  0.333959  0.633077  1
  Cu  Cu219  1  0.764468  0.512711  0.576908  1
  Cu  Cu220  1  -0.001217  0.019159  0.640525  1
  Cu  Cu221  1  0.103953  0.193249  0.612466  1
  Cu  Cu222  1  0.048841  0.342036  0.621223  1
  Cu  Cu223  1  0.489698  0.214326  0.603520  1
  Cu  Cu224  1  0.438711  0.355524  0.609532  1
  Cu  Cu225  1  0.390108  0.500244  0.617821  1
  Cu  Cu226  1  0.664298  0.801386  0.592406  1
  Cu  Cu227  1  0.781502  0.027157  0.613089  1
  Cu  Cu228  1  0.718609  0.177388  0.621515  1
  Cu  Cu229  1  0.103716  0.670423  0.572844  1
  Cu  Cu230  1  0.050826  0.818488  0.581803  1
  Cu  Cu231  1  0.492602  0.677808  0.561105  1
  Cu  Cu232  1  0.437683  0.830474  0.571816  1
  Cu  Cu233  1  0.378574  0.982497  0.581270  1
  Cu  Cu234  1  0.714379  0.658753  0.585338  1
  Cu  Cu235  1  0.993010  0.438191  0.580191  1
  Cu  Cu236  1  0.493544  0.266896  0.653602  1
  Cu  Cu237  1  0.603463  0.431391  0.592462  1
  Cu  Cu238  1  0.841108  0.879835  0.606586  1
  Cu  Cu239  1  0.932433  0.115837  0.599121  1
  Cu  Cu240  1  0.872877  0.266663  0.609225  1
  Cu  Cu241  1  0.316781  0.131812  0.588599  1
  Cu  Cu242  1  0.259682  0.280303  0.596712  1
  Cu  Cu243  1  0.209056  0.427986  0.605563  1
  Cu  Cu244  1  0.499970  0.729900  0.611678  1
  Cu  Cu245  1  0.610433  0.939958  0.596657  1
  Cu  Cu246  1  0.548688  0.076866  0.600264  1
  Cu  Cu247  1  0.943788  0.585410  0.589170  1
  Cu  Cu248  1  0.894461  0.732456  0.598022  1
  Cu  Cu249  1  0.332997  0.595079  0.575876  1
  Cu  Cu250  1  0.280987  0.744464  0.585256  1
  Cu  Cu251  1  0.225728  0.894720  0.595052  1
  Cu  Cu252  1  0.552652  0.579976  0.601963  1
  Cu  Cu253  1  -0.000170  0.490849  0.631155  1
  Cu  Cu254  1  0.497477  0.320213  0.703098  1
  Cu  Cu255  1  0.611188  0.483728  0.643444  1
  Cu  Cu256  1  0.848791  0.933084  0.657497  1
  Cu  Cu257  1  0.935308  0.167670  0.649950  1
  Cu  Cu258  1  0.876864  0.319222  0.659589  1
  Cu  Cu259  1  0.320435  0.184359  0.638648  1
  Cu  Cu260  1  0.264740  0.333725  0.647179  1
  Cu  Cu261  1  0.215613  0.480500  0.656394  1
  Cu  Cu262  1  0.507657  0.782095  0.661717  1
  Cu  Cu263  1  0.616521  0.992385  0.646963  1
  Cu  Cu264  1  0.552816  0.129571  0.650975  1
  Cu  Cu265  1  0.951548  0.638031  0.639836  1
  Cu  Cu266  1  0.903164  0.784895  0.648591  1
  Cu  Cu267  1  0.340702  0.647056  0.626109  1
  Cu  Cu268  1  0.288586  0.797650  0.635802  1
  Cu  Cu269  1  0.231864  0.948054  0.645827  1
  Cu  Cu270  1  0.560759  0.631746  0.652562  1
  Cu  Cu271  1  0.821356  0.417694  0.619060  1
  Cu  Cu272  1  0.322346  0.238126  0.687835  1
  Cu  Cu273  1  0.445158  0.408128  0.660017  1
  Cu  Cu274  1  0.672378  0.853794  0.643167  1
  Cu  Cu275  1  0.782949  0.078259  0.663519  1
  Cu  Cu276  1  0.720629  0.229932  0.671245  1
  Cu  Cu277  1  0.167874  0.097256  0.654501  1
  Cu  Cu278  1  0.106873  0.246191  0.662678  1
  Cu  Cu279  1  0.055395  0.393056  0.671395  1
  Cu  Cu280  1  0.349736  0.698830  0.675637  1
  Cu  Cu281  1  0.444718  0.884428  0.623065  1
  Cu  Cu282  1  0.383602  0.035380  0.631839  1
  Cu  Cu283  1  0.771879  0.565103  0.627857  1
  Cu  Cu284  1  0.722070  0.711166  0.636150  1
  Cu  Cu285  1  0.160487  0.574760  0.614254  1
  Cu  Cu286  1  0.111626  0.723199  0.623785  1
  Cu  Cu287  1  0.058091  0.871270  0.632810  1
  Cu  Cu288  1  0.398256  0.552032  0.668275  1
  Cu  Cu289  1  0.830675  0.470464  0.670382  1
  Cu  Cu290  1  0.333239  0.286510  0.736687  1
  Cu  Cu291  1  0.454567  0.460201  0.710115  1
  Cu  Cu292  1  0.684501  0.906483  0.692750  1
  Cu  Cu293  1  0.782116  0.133690  0.711899  1
  Cu  Cu294  1  0.721319  0.277582  0.720596  1
  Cu  Cu295  1  0.166709  0.151912  0.704237  1
  Cu  Cu296  1  0.114591  0.298578  0.712989  1
  Cu  Cu297  1  0.059923  0.445525  0.720007  1
  Cu  Cu298  1  0.354347  0.751940  0.723687  1
  Cu  Cu299  1  0.452674  0.939244  0.674215  1
  Cu  Cu300  1  0.383838  0.090520  0.681299  1
  Cu  Cu301  1  0.780107  0.618540  0.678288  1
  Cu  Cu302  1  0.731800  0.764186  0.686335  1
  Cu  Cu303  1  0.169746  0.626806  0.664415  1
  Cu  Cu304  1  0.122990  0.776382  0.674688  1
  Cu  Cu305  1  0.063453  0.925703  0.683100  1
  Cu  Cu306  1  0.407655  0.605836  0.717236  1
  Cu  Cu307  1  0.667700  0.386488  0.683941  1
  Cu  Cu308  1  0.376349  0.145298  0.729881  1
  Cu  Cu309  1  0.270515  0.387192  0.697788  1
  Cu  Cu310  1  0.520050  0.831446  0.710449  1
  Cu  Cu311  1  0.611360  0.044827  0.697618  1
  Cu  Cu312  1  0.551436  0.183687  0.701411  1
  Cu  Cu313  1  -0.002720  0.071396  0.690964  1
  Cu  Cu314  1  0.937810  0.222094  0.699811  1
  Cu  Cu315  1  0.883697  0.367849  0.709529  1
  Cu  Cu316  1  0.178936  0.677135  0.713818  1
  Cu  Cu317  1  0.296848  0.851963  0.686056  1
  Cu  Cu318  1  0.235519  1.003165  0.695780  1
  Cu  Cu319  1  0.619795  0.536194  0.693789  1
  Cu  Cu320  1  0.568745  0.685440  0.702211  1
  Cu  Cu321  1  0.008763  0.544483  0.681784  1
  Cu  Cu322  1  0.961945  0.690731  0.689927  1
  Cu  Cu323  1  0.914468  0.836069  0.698086  1
  Cu  Cu324  1  0.224744  0.532896  0.706663  1
