# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   13.49980089
_cell_length_b   13.58376539
_cell_length_c   46.97264459
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   94.08253014
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu
_chemical_formula_sum   Cu324
_cell_volume   8591.89854681
_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  0.248427  0.665546  0.303987  1
  Cu  Cu2  1  0.258170  0.309585  0.320242  1
  Cu  Cu3  1  0.405291  0.353368  0.288559  1
  Cu  Cu4  1  0.581761  0.332213  0.303987  1
  Cu  Cu5  1  0.238625  0.020035  0.288559  1
  Cu  Cu6  1  0.415094  0.998879  0.303987  1
  Cu  Cu7  1  0.424836  0.642919  0.320242  1
  Cu  Cu8  1  0.571958  0.686701  0.288559  1
  Cu  Cu9  1  0.748427  0.665546  0.303987  1
  Cu  Cu10  1  0.758170  0.309585  0.320242  1
  Cu  Cu11  1  0.905291  0.353368  0.288559  1
  Cu  Cu12  1  0.081761  0.332213  0.303987  1
  Cu  Cu13  1  0.591503  0.976252  0.320242  1
  Cu  Cu14  1  0.738625  0.020035  0.288559  1
  Cu  Cu15  1  0.915094  0.998879  0.303987  1
  Cu  Cu16  1  0.924836  0.642919  0.320242  1
  Cu  Cu17  1  0.071958  0.686701  0.288559  1
  Cu  Cu18  1  0.091503  0.976252  0.320242  1
  Cu  Cu19  1  0.298461  0.845985  0.294133  1
  Cu  Cu20  1  0.307207  0.490552  0.309630  1
  Cu  Cu21  1  0.457931  0.533432  0.278779  1
  Cu  Cu22  1  0.631794  0.512651  0.294133  1
  Cu  Cu23  1  0.291265  0.200099  0.278779  1
  Cu  Cu24  1  0.465127  0.179318  0.294133  1
  Cu  Cu25  1  0.473874  0.823885  0.309630  1
  Cu  Cu26  1  0.624598  0.866765  0.278779  1
  Cu  Cu27  1  0.798461  0.845985  0.294133  1
  Cu  Cu28  1  0.807207  0.490552  0.309630  1
  Cu  Cu29  1  0.957931  0.533432  0.278779  1
  Cu  Cu30  1  0.131794  0.512651  0.294133  1
  Cu  Cu31  1  0.640540  0.157219  0.309630  1
  Cu  Cu32  1  0.791265  0.200099  0.278779  1
  Cu  Cu33  1  0.965127  0.179318  0.294133  1
  Cu  Cu34  1  0.973874  0.823885  0.309630  1
  Cu  Cu35  1  0.124598  0.866765  0.278779  1
  Cu  Cu36  1  0.140540  0.157219  0.309630  1
  Cu  Cu37  1  0.279014  0.596312  0.353453  1
  Cu  Cu38  1  0.288982  0.240366  0.370408  1
  Cu  Cu39  1  0.435259  0.285541  0.336991  1
  Cu  Cu40  1  0.612347  0.262979  0.353453  1
  Cu  Cu41  1  0.268592  0.952208  0.336991  1
  Cu  Cu42  1  0.445680  0.929646  0.353453  1
  Cu  Cu43  1  0.455649  0.573699  0.370408  1
  Cu  Cu44  1  0.601926  0.618874  0.336991  1
  Cu  Cu45  1  0.779014  0.596312  0.353453  1
  Cu  Cu46  1  0.788982  0.240366  0.370408  1
  Cu  Cu47  1  0.935259  0.285541  0.336991  1
  Cu  Cu48  1  0.112347  0.262979  0.353453  1
  Cu  Cu49  1  0.622316  0.907033  0.370408  1
  Cu  Cu50  1  0.768592  0.952208  0.336991  1
  Cu  Cu51  1  0.945680  0.929646  0.353453  1
  Cu  Cu52  1  0.955649  0.573699  0.370408  1
  Cu  Cu53  1  0.101926  0.618874  0.336991  1
  Cu  Cu54  1  0.122316  0.907033  0.370408  1
  Cu  Cu55  1  0.327650  0.777824  0.342962  1
  Cu  Cu56  1  0.337309  0.421666  0.359348  1
  Cu  Cu57  1  0.484064  0.467447  0.326604  1
  Cu  Cu58  1  0.660983  0.444490  0.342962  1
  Cu  Cu59  1  0.317397  0.134113  0.326604  1
  Cu  Cu60  1  0.494316  0.111157  0.342962  1
  Cu  Cu61  1  0.503975  0.755000  0.359348  1
  Cu  Cu62  1  0.650731  0.800780  0.326604  1
  Cu  Cu63  1  0.827650  0.777824  0.342962  1
  Cu  Cu64  1  0.837309  0.421666  0.359348  1
  Cu  Cu65  1  0.984064  0.467447  0.326604  1
  Cu  Cu66  1  0.160983  0.444490  0.342962  1
  Cu  Cu67  1  0.670642  0.088333  0.359348  1
  Cu  Cu68  1  0.817397  0.134113  0.326604  1
  Cu  Cu69  1  0.994316  0.111157  0.342962  1
  Cu  Cu70  1  0.003975  0.755000  0.359348  1
  Cu  Cu71  1  0.150731  0.800780  0.326604  1
  Cu  Cu72  1  0.170642  0.088333  0.359348  1
  Cu  Cu73  1  0.309605  0.527645  0.403764  1
  Cu  Cu74  1  0.319926  0.171424  0.420574  1
  Cu  Cu75  1  0.466088  0.217287  0.387105  1
  Cu  Cu76  1  0.642939  0.194312  0.403764  1
  Cu  Cu77  1  0.299422  0.883953  0.387105  1
  Cu  Cu78  1  0.476272  0.860979  0.403764  1
  Cu  Cu79  1  0.486593  0.504758  0.420574  1
  Cu  Cu80  1  0.632755  0.550620  0.387105  1
  Cu  Cu81  1  0.809605  0.527645  0.403764  1
  Cu  Cu82  1  0.819926  0.171424  0.420574  1
  Cu  Cu83  1  0.966088  0.217287  0.387105  1
  Cu  Cu84  1  0.142939  0.194312  0.403764  1
  Cu  Cu85  1  0.653259  0.838091  0.420574  1
  Cu  Cu86  1  0.799422  0.883953  0.387105  1
  Cu  Cu87  1  0.976272  0.860979  0.403764  1
  Cu  Cu88  1  0.986593  0.504758  0.420574  1
  Cu  Cu89  1  0.132755  0.550620  0.387105  1
  Cu  Cu90  1  0.153259  0.838091  0.420574  1
  Cu  Cu91  1  0.357445  0.709217  0.392899  1
  Cu  Cu92  1  0.367610  0.353109  0.409629  1
  Cu  Cu93  1  0.514073  0.398721  0.376217  1
  Cu  Cu94  1  0.690779  0.375883  0.392899  1
  Cu  Cu95  1  0.347406  0.065387  0.376217  1
  Cu  Cu96  1  0.524112  0.042550  0.392899  1
  Cu  Cu97  1  0.534277  0.686443  0.409629  1
  Cu  Cu98  1  0.680739  0.732054  0.376217  1
  Cu  Cu99  1  0.857445  0.709217  0.392899  1
  Cu  Cu100  1  0.867610  0.353109  0.409629  1
  Cu  Cu101  1  0.014073  0.398721  0.376217  1
  Cu  Cu102  1  0.190779  0.375883  0.392899  1
  Cu  Cu103  1  0.700943  0.019776  0.409629  1
  Cu  Cu104  1  0.847406  0.065387  0.376217  1
  Cu  Cu105  1  0.024112  0.042550  0.392899  1
  Cu  Cu106  1  0.034277  0.686443  0.409629  1
  Cu  Cu107  1  0.180739  0.732054  0.376217  1
  Cu  Cu108  1  0.200943  0.019776  0.409629  1
  Cu  Cu109  1  0.340411  0.458890  0.454012  1
  Cu  Cu110  1  0.350671  0.102640  0.470755  1
  Cu  Cu111  1  0.496870  0.148473  0.437281  1
  Cu  Cu112  1  0.673744  0.125556  0.454012  1
  Cu  Cu113  1  0.330203  0.815140  0.437281  1
  Cu  Cu114  1  0.507077  0.792223  0.454012  1
  Cu  Cu115  1  0.517337  0.435973  0.470755  1
  Cu  Cu116  1  0.663536  0.481806  0.437281  1
  Cu  Cu117  1  0.840411  0.458890  0.454012  1
  Cu  Cu118  1  0.850671  0.102640  0.470755  1
  Cu  Cu119  1  0.996870  0.148473  0.437281  1
  Cu  Cu120  1  0.173744  0.125556  0.454012  1
  Cu  Cu121  1  0.684004  0.769306  0.470755  1
  Cu  Cu122  1  0.830203  0.815140  0.437281  1
  Cu  Cu123  1  0.007077  0.792223  0.454012  1
  Cu  Cu124  1  0.017337  0.435973  0.470755  1
  Cu  Cu125  1  0.163536  0.481806  0.437281  1
  Cu  Cu126  1  0.184004  0.769306  0.470755  1
  Cu  Cu127  1  0.388018  0.640505  0.443065  1
  Cu  Cu128  1  0.398269  0.284287  0.459817  1
  Cu  Cu129  1  0.544469  0.330123  0.426378  1
  Cu  Cu130  1  0.721351  0.307172  0.443065  1
  Cu  Cu131  1  0.377802  0.996789  0.426378  1
  Cu  Cu132  1  0.554685  0.973838  0.443065  1
  Cu  Cu133  1  0.564935  0.617621  0.459817  1
  Cu  Cu134  1  0.711135  0.663456  0.426378  1
  Cu  Cu135  1  0.888018  0.640505  0.443065  1
  Cu  Cu136  1  0.898269  0.284287  0.459817  1
  Cu  Cu137  1  0.044469  0.330123  0.426378  1
  Cu  Cu138  1  0.221351  0.307172  0.443065  1
  Cu  Cu139  1  0.731602  0.950954  0.459817  1
  Cu  Cu140  1  0.877802  0.996789  0.426378  1
  Cu  Cu141  1  0.054685  0.973838  0.443065  1
  Cu  Cu142  1  0.064935  0.617621  0.459817  1
  Cu  Cu143  1  0.211135  0.663456  0.426378  1
  Cu  Cu144  1  0.231602  0.950954  0.459817  1
  Cu  Cu145  1  0.371168  0.390117  0.504216  1
  Cu  Cu146  1  0.381415  0.033866  0.520934  1
  Cu  Cu147  1  0.527588  0.079698  0.487471  1
  Cu  Cu148  1  0.704501  0.056784  0.504216  1
  Cu  Cu149  1  0.360921  0.746365  0.487471  1
  Cu  Cu150  1  0.537834  0.723450  0.504216  1
  Cu  Cu151  1  0.548081  0.367199  0.520934  1
  Cu  Cu152  1  0.694255  0.413031  0.487471  1
  Cu  Cu153  1  0.871168  0.390117  0.504216  1
  Cu  Cu154  1  0.881415  0.033866  0.520934  1
  Cu  Cu155  1  0.027588  0.079698  0.487471  1
  Cu  Cu156  1  0.204501  0.056784  0.504216  1
  Cu  Cu157  1  0.714748  0.700533  0.520934  1
  Cu  Cu158  1  0.860921  0.746365  0.487471  1
  Cu  Cu159  1  0.037834  0.723450  0.504216  1
  Cu  Cu160  1  0.048081  0.367199  0.520934  1
  Cu  Cu161  1  0.194255  0.413031  0.487471  1
  Cu  Cu162  1  0.214748  0.700533  0.520934  1
  Cu  Cu163  1  0.418757  0.571767  0.493264  1
  Cu  Cu164  1  0.429003  0.215520  0.510009  1
  Cu  Cu165  1  0.575176  0.261352  0.476545  1
  Cu  Cu166  1  0.752090  0.238434  0.493264  1
  Cu  Cu167  1  0.408509  0.928018  0.476545  1
  Cu  Cu168  1  0.585423  0.905101  0.493264  1
  Cu  Cu169  1  0.595669  0.548853  0.510009  1
  Cu  Cu170  1  0.741843  0.594685  0.476545  1
  Cu  Cu171  1  0.918757  0.571767  0.493264  1
  Cu  Cu172  1  0.929003  0.215520  0.510009  1
  Cu  Cu173  1  0.075176  0.261352  0.476545  1
  Cu  Cu174  1  0.252090  0.238434  0.493264  1
  Cu  Cu175  1  0.762336  0.882186  0.510009  1
  Cu  Cu176  1  0.908509  0.928018  0.476545  1
  Cu  Cu177  1  0.085423  0.905101  0.493264  1
  Cu  Cu178  1  0.095669  0.548853  0.510009  1
  Cu  Cu179  1  0.241843  0.594685  0.476545  1
  Cu  Cu180  1  0.262336  0.882186  0.510009  1
  Cu  Cu181  1  0.401906  0.321379  0.554415  1
  Cu  Cu182  1  0.412122  0.965095  0.571102  1
  Cu  Cu183  1  0.558322  0.010930  0.537662  1
  Cu  Cu184  1  0.735240  0.988046  0.554415  1
  Cu  Cu185  1  0.391655  0.677597  0.537662  1
  Cu  Cu186  1  0.568573  0.654713  0.554415  1
  Cu  Cu187  1  0.578789  0.298428  0.571102  1
  Cu  Cu188  1  0.724989  0.344264  0.537662  1
  Cu  Cu189  1  0.901906  0.321379  0.554415  1
  Cu  Cu190  1  0.912122  0.965095  0.571102  1
  Cu  Cu191  1  0.058322  0.010930  0.537662  1
  Cu  Cu192  1  0.235240  0.988046  0.554415  1
  Cu  Cu193  1  0.745456  0.631762  0.571102  1
  Cu  Cu194  1  0.891655  0.677597  0.537662  1
  Cu  Cu195  1  0.068573  0.654713  0.554415  1
  Cu  Cu196  1  0.078789  0.298428  0.571102  1
  Cu  Cu197  1  0.224989  0.344264  0.537662  1
  Cu  Cu198  1  0.245456  0.631762  0.571102  1
  Cu  Cu199  1  0.449513  0.502995  0.543467  1
  Cu  Cu200  1  0.459721  0.146745  0.560199  1
  Cu  Cu201  1  0.605920  0.192578  0.526725  1
  Cu  Cu202  1  0.782847  0.169661  0.543467  1
  Cu  Cu203  1  0.439254  0.859245  0.526725  1
  Cu  Cu204  1  0.616180  0.836328  0.543467  1
  Cu  Cu205  1  0.626388  0.480078  0.560199  1
  Cu  Cu206  1  0.772587  0.525911  0.526725  1
  Cu  Cu207  1  0.949513  0.502995  0.543467  1
  Cu  Cu208  1  0.959721  0.146745  0.560199  1
  Cu  Cu209  1  0.105920  0.192578  0.526725  1
  Cu  Cu210  1  0.282847  0.169661  0.543467  1
  Cu  Cu211  1  0.793054  0.813411  0.560199  1
  Cu  Cu212  1  0.939254  0.859245  0.526725  1
  Cu  Cu213  1  0.116180  0.836328  0.543467  1
  Cu  Cu214  1  0.126388  0.480078  0.560199  1
  Cu  Cu215  1  0.272587  0.525911  0.526725  1
  Cu  Cu216  1  0.293054  0.813411  0.560199  1
  Cu  Cu217  1  0.432479  0.252668  0.604581  1
  Cu  Cu218  1  0.442518  0.896497  0.621262  1
  Cu  Cu219  1  0.588981  0.942108  0.587851  1
  Cu  Cu220  1  0.765812  0.919334  0.604581  1
  Cu  Cu221  1  0.422314  0.608775  0.587851  1
  Cu  Cu222  1  0.599145  0.586001  0.604581  1
  Cu  Cu223  1  0.609185  0.229830  0.621262  1
  Cu  Cu224  1  0.755647  0.275442  0.587851  1
  Cu  Cu225  1  0.932479  0.252668  0.604581  1
  Cu  Cu226  1  0.942518  0.896497  0.621262  1
  Cu  Cu227  1  0.088981  0.942108  0.587851  1
  Cu  Cu228  1  0.265812  0.919334  0.604581  1
  Cu  Cu229  1  0.775851  0.563164  0.621262  1
  Cu  Cu230  1  0.922314  0.608775  0.587851  1
  Cu  Cu231  1  0.099145  0.586001  0.604581  1
  Cu  Cu232  1  0.109185  0.229830  0.621262  1
  Cu  Cu233  1  0.255647  0.275442  0.587851  1
  Cu  Cu234  1  0.275851  0.563164  0.621262  1
  Cu  Cu235  1  0.480319  0.434239  0.593716  1
  Cu  Cu236  1  0.490502  0.077931  0.610375  1
  Cu  Cu237  1  0.636665  0.123793  0.576906  1
  Cu  Cu238  1  0.813652  0.100906  0.593716  1
  Cu  Cu239  1  0.469998  0.790460  0.576906  1
  Cu  Cu240  1  0.646986  0.767572  0.593716  1
  Cu  Cu241  1  0.657169  0.411264  0.610375  1
  Cu  Cu242  1  0.803331  0.457127  0.576906  1
  Cu  Cu243  1  0.980319  0.434239  0.593716  1
  Cu  Cu244  1  0.990502  0.077931  0.610375  1
  Cu  Cu245  1  0.136665  0.123793  0.576906  1
  Cu  Cu246  1  0.313652  0.100906  0.593716  1
  Cu  Cu247  1  0.823836  0.744598  0.610375  1
  Cu  Cu248  1  0.969998  0.790460  0.576906  1
  Cu  Cu249  1  0.146986  0.767572  0.593716  1
  Cu  Cu250  1  0.157169  0.411264  0.610375  1
  Cu  Cu251  1  0.303331  0.457127  0.576906  1
  Cu  Cu252  1  0.323836  0.744598  0.610375  1
  Cu  Cu253  1  0.462274  0.184061  0.654518  1
  Cu  Cu254  1  0.472527  0.827771  0.670876  1
  Cu  Cu255  1  0.619282  0.873551  0.638131  1
  Cu  Cu256  1  0.795608  0.850727  0.654518  1
  Cu  Cu257  1  0.452615  0.540218  0.638131  1
  Cu  Cu258  1  0.628941  0.517394  0.654518  1
  Cu  Cu259  1  0.639193  0.161104  0.670876  1
  Cu  Cu260  1  0.785949  0.206885  0.638131  1
  Cu  Cu261  1  0.962274  0.184061  0.654518  1
  Cu  Cu262  1  0.972527  0.827771  0.670876  1
  Cu  Cu263  1  0.119282  0.873551  0.638131  1
  Cu  Cu264  1  0.295608  0.850727  0.654518  1
  Cu  Cu265  1  0.805860  0.494438  0.670876  1
  Cu  Cu266  1  0.952615  0.540218  0.638131  1
  Cu  Cu267  1  0.128941  0.517394  0.654518  1
  Cu  Cu268  1  0.139193  0.161104  0.670876  1
  Cu  Cu269  1  0.285949  0.206885  0.638131  1
  Cu  Cu270  1  0.305860  0.494438  0.670876  1
  Cu  Cu271  1  0.510910  0.365572  0.644027  1
  Cu  Cu272  1  0.521332  0.009677  0.660488  1
  Cu  Cu273  1  0.667609  0.054852  0.627072  1
  Cu  Cu274  1  0.844244  0.032239  0.644027  1
  Cu  Cu275  1  0.500942  0.721518  0.627072  1
  Cu  Cu276  1  0.677577  0.698905  0.644027  1
  Cu  Cu277  1  0.687998  0.343010  0.660488  1
  Cu  Cu278  1  0.834275  0.388185  0.627072  1
  Cu  Cu279  1  0.010910  0.365572  0.644027  1
  Cu  Cu280  1  0.021332  0.009677  0.660488  1
  Cu  Cu281  1  0.167609  0.054852  0.627072  1
  Cu  Cu282  1  0.344244  0.032239  0.644027  1
  Cu  Cu283  1  0.854665  0.676343  0.660488  1
  Cu  Cu284  1  1.000942  0.721518  0.627072  1
  Cu  Cu285  1  0.177577  0.698905  0.644027  1
  Cu  Cu286  1  0.187998  0.343010  0.660488  1
  Cu  Cu287  1  0.334275  0.388185  0.627072  1
  Cu  Cu288  1  0.354665  0.676343  0.660488  1
  Cu  Cu289  1  0.491464  0.115900  0.703347  1
  Cu  Cu290  1  0.498659  0.761786  0.718701  1
  Cu  Cu291  1  0.649384  0.804666  0.687850  1
  Cu  Cu292  1  0.824797  0.782566  0.703347  1
  Cu  Cu293  1  0.482717  0.471332  0.687850  1
  Cu  Cu294  1  0.658130  0.449233  0.703347  1
  Cu  Cu295  1  0.665326  0.095119  0.718701  1
  Cu  Cu296  1  0.816050  0.137999  0.687850  1
  Cu  Cu297  1  0.991464  0.115900  0.703347  1
  Cu  Cu298  1  0.998659  0.761786  0.718701  1
  Cu  Cu299  1  0.149384  0.804666  0.687850  1
  Cu  Cu300  1  0.324797  0.782566  0.703347  1
  Cu  Cu301  1  0.831993  0.428452  0.718701  1
  Cu  Cu302  1  0.982717  0.471332  0.687850  1
  Cu  Cu303  1  0.158130  0.449233  0.703347  1
  Cu  Cu304  1  0.165326  0.095119  0.718701  1
  Cu  Cu305  1  0.316050  0.137999  0.687850  1
  Cu  Cu306  1  0.331993  0.428452  0.718701  1
  Cu  Cu307  1  0.541497  0.296338  0.693493  1
  Cu  Cu308  1  0.551299  0.941850  0.708920  1
  Cu  Cu309  1  0.698421  0.985632  0.677238  1
  Cu  Cu310  1  0.874830  0.963005  0.693493  1
  Cu  Cu311  1  0.531754  0.652299  0.677238  1
  Cu  Cu312  1  0.708164  0.629672  0.693493  1
  Cu  Cu313  1  0.717966  0.275183  0.708920  1
  Cu  Cu314  1  0.865088  0.318966  0.677238  1
  Cu  Cu315  1  0.041497  0.296338  0.693493  1
  Cu  Cu316  1  0.051299  0.941850  0.708920  1
  Cu  Cu317  1  0.198421  0.985632  0.677238  1
  Cu  Cu318  1  0.374830  0.963005  0.693493  1
  Cu  Cu319  1  0.884633  0.608516  0.708920  1
  Cu  Cu320  1  0.031754  0.652299  0.677238  1
  Cu  Cu321  1  0.208164  0.629672  0.693493  1
  Cu  Cu322  1  0.217966  0.275183  0.708920  1
  Cu  Cu323  1  0.365088  0.318966  0.677238  1
  Cu  Cu324  1  0.384633  0.608516  0.708920  1
