# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.07150404
_cell_length_b   17.40461421
_cell_length_c   46.66590800
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   76.39954030
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu
_chemical_formula_sum   Cu336
_cell_volume   8740.14707696
_cell_formula_units_Z   336
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  0.998871  0.599781  0.299631  1
  Cu  Cu2  1  0.390752  0.605379  0.289722  1
  Cu  Cu3  1  0.782912  0.611309  0.279966  1
  Cu  Cu4  1  0.998871  0.099781  0.299631  1
  Cu  Cu5  1  0.390752  0.105379  0.289722  1
  Cu  Cu6  1  0.782912  0.111309  0.279966  1
  Cu  Cu7  1  0.210622  0.724091  0.300452  1
  Cu  Cu8  1  0.602934  0.729754  0.290246  1
  Cu  Cu9  1  0.994296  0.736787  0.280986  1
  Cu  Cu10  1  0.210622  0.224091  0.300452  1
  Cu  Cu11  1  0.602934  0.229754  0.290246  1
  Cu  Cu12  1  0.994296  0.236787  0.280986  1
  Cu  Cu13  1  0.082432  0.359601  0.284748  1
  Cu  Cu14  1  0.478525  0.365211  0.274889  1
  Cu  Cu15  1  0.695959  0.351647  0.294341  1
  Cu  Cu16  1  0.082432  0.859601  0.284748  1
  Cu  Cu17  1  0.478525  0.865211  0.274889  1
  Cu  Cu18  1  0.695959  0.851647  0.294341  1
  Cu  Cu19  1  0.177319  0.480262  0.288645  1
  Cu  Cu20  1  0.567682  0.486607  0.278628  1
  Cu  Cu21  1  0.786055  0.474857  0.298464  1
  Cu  Cu22  1  0.177319  0.980262  0.288645  1
  Cu  Cu23  1  0.567682  0.986607  0.278628  1
  Cu  Cu24  1  0.786055  0.974857  0.298464  1
  Cu  Cu25  1  0.819750  0.583889  0.332654  1
  Cu  Cu26  1  0.211458  0.589874  0.321235  1
  Cu  Cu27  1  0.605552  0.594358  0.310951  1
  Cu  Cu28  1  0.819750  0.083889  0.332654  1
  Cu  Cu29  1  0.211458  0.089874  0.321235  1
  Cu  Cu30  1  0.605552  0.094358  0.310951  1
  Cu  Cu31  1  0.033890  0.708604  0.333578  1
  Cu  Cu32  1  0.425963  0.714240  0.322152  1
  Cu  Cu33  1  0.818231  0.718921  0.312115  1
  Cu  Cu34  1  0.033890  0.208604  0.333578  1
  Cu  Cu35  1  0.425963  0.214240  0.322152  1
  Cu  Cu36  1  0.818231  0.218921  0.312115  1
  Cu  Cu37  1  0.907595  0.342431  0.316725  1
  Cu  Cu38  1  0.300538  0.346291  0.305060  1
  Cu  Cu39  1  0.516737  0.336726  0.327185  1
  Cu  Cu40  1  0.907595  0.842431  0.316725  1
  Cu  Cu41  1  0.300538  0.846291  0.305060  1
  Cu  Cu42  1  0.516737  0.836726  0.327185  1
  Cu  Cu43  1  0.997534  0.465987  0.320405  1
  Cu  Cu44  1  0.389790  0.470662  0.310210  1
  Cu  Cu45  1  0.605975  0.458942  0.331180  1
  Cu  Cu46  1  0.997534  0.965987  0.320405  1
  Cu  Cu47  1  0.389790  0.970662  0.310210  1
  Cu  Cu48  1  0.605975  0.958942  0.331180  1
  Cu  Cu49  1  0.641235  0.567796  0.364721  1
  Cu  Cu50  1  0.034272  0.573468  0.353772  1
  Cu  Cu51  1  0.427134  0.578738  0.343044  1
  Cu  Cu52  1  0.641235  0.067796  0.364721  1
  Cu  Cu53  1  0.034272  0.073468  0.353772  1
  Cu  Cu54  1  0.427134  0.078738  0.343044  1
  Cu  Cu55  1  0.856476  0.692469  0.365786  1
  Cu  Cu56  1  0.249254  0.697845  0.354537  1
  Cu  Cu57  1  0.641143  0.703008  0.344036  1
  Cu  Cu58  1  0.856476  0.192469  0.365786  1
  Cu  Cu59  1  0.249254  0.197845  0.354537  1
  Cu  Cu60  1  0.641143  0.203008  0.344036  1
  Cu  Cu61  1  0.730271  0.325800  0.348623  1
  Cu  Cu62  1  0.123041  0.331139  0.337568  1
  Cu  Cu63  1  0.337728  0.320692  0.359055  1
  Cu  Cu64  1  0.730271  0.825800  0.348623  1
  Cu  Cu65  1  0.123041  0.831139  0.337568  1
  Cu  Cu66  1  0.337728  0.820692  0.359055  1
  Cu  Cu67  1  0.818689  0.449074  0.352798  1
  Cu  Cu68  1  0.211572  0.453904  0.341944  1
  Cu  Cu69  1  0.426233  0.443496  0.363667  1
  Cu  Cu70  1  0.818689  0.949074  0.352798  1
  Cu  Cu71  1  0.211572  0.953904  0.341944  1
  Cu  Cu72  1  0.426233  0.943496  0.363667  1
  Cu  Cu73  1  0.463058  0.551923  0.396914  1
  Cu  Cu74  1  0.856081  0.557155  0.386276  1
  Cu  Cu75  1  0.248700  0.562605  0.375161  1
  Cu  Cu76  1  0.463058  0.051923  0.396914  1
  Cu  Cu77  1  0.856081  0.057155  0.386276  1
  Cu  Cu78  1  0.248700  0.062605  0.375161  1
  Cu  Cu79  1  0.678580  0.676302  0.397908  1
  Cu  Cu80  1  0.071684  0.681667  0.387196  1
  Cu  Cu81  1  0.463676  0.687214  0.376215  1
  Cu  Cu82  1  0.678580  0.176302  0.397908  1
  Cu  Cu83  1  0.071684  0.181667  0.387196  1
  Cu  Cu84  1  0.463676  0.187214  0.376215  1
  Cu  Cu85  1  0.552134  0.309795  0.380884  1
  Cu  Cu86  1  0.944856  0.315341  0.370198  1
  Cu  Cu87  1  0.159644  0.304499  0.391418  1
  Cu  Cu88  1  0.552134  0.809795  0.380884  1
  Cu  Cu89  1  0.944856  0.815341  0.370198  1
  Cu  Cu90  1  0.159644  0.804499  0.391418  1
  Cu  Cu91  1  0.640307  0.432660  0.385165  1
  Cu  Cu92  1  0.032994  0.438111  0.374222  1
  Cu  Cu93  1  0.247458  0.427376  0.395799  1
  Cu  Cu94  1  0.640307  0.932660  0.385165  1
  Cu  Cu95  1  0.032994  0.938111  0.374222  1
  Cu  Cu96  1  0.247458  0.927376  0.395799  1
  Cu  Cu97  1  0.284853  0.535796  0.429120  1
  Cu  Cu98  1  0.677631  0.541093  0.418493  1
  Cu  Cu99  1  0.070576  0.546442  0.407622  1
  Cu  Cu100  1  0.284853  0.035796  0.429120  1
  Cu  Cu101  1  0.677631  0.041093  0.418493  1
  Cu  Cu102  1  0.070576  0.046442  0.407622  1
  Cu  Cu103  1  0.500519  0.660336  0.430144  1
  Cu  Cu104  1  0.893494  0.665598  0.419503  1
  Cu  Cu105  1  0.286040  0.670988  0.408557  1
  Cu  Cu106  1  0.500519  0.160336  0.430144  1
  Cu  Cu107  1  0.893494  0.165598  0.419503  1
  Cu  Cu108  1  0.286040  0.170988  0.408557  1
  Cu  Cu109  1  0.373859  0.293839  0.413002  1
  Cu  Cu110  1  0.766642  0.299150  0.402427  1
  Cu  Cu111  1  0.981383  0.288406  0.423877  1
  Cu  Cu112  1  0.373859  0.793839  0.413002  1
  Cu  Cu113  1  0.766642  0.799150  0.402427  1
  Cu  Cu114  1  0.981383  0.788406  0.423877  1
  Cu  Cu115  1  0.461829  0.416648  0.417459  1
  Cu  Cu116  1  0.854595  0.422036  0.406688  1
  Cu  Cu117  1  0.069121  0.411241  0.428109  1
  Cu  Cu118  1  0.461829  0.916648  0.417459  1
  Cu  Cu119  1  0.854595  0.922036  0.406688  1
  Cu  Cu120  1  0.069121  0.911241  0.428109  1
  Cu  Cu121  1  0.106709  0.519633  0.461482  1
  Cu  Cu122  1  0.499329  0.525082  0.450722  1
  Cu  Cu123  1  0.892292  0.530352  0.440017  1
  Cu  Cu124  1  0.106709  0.019633  0.461482  1
  Cu  Cu125  1  0.499329  0.025082  0.450722  1
  Cu  Cu126  1  0.892292  0.030352  0.440017  1
  Cu  Cu127  1  0.322470  0.644186  0.462467  1
  Cu  Cu128  1  0.715219  0.649525  0.451725  1
  Cu  Cu129  1  0.108074  0.654836  0.440991  1
  Cu  Cu130  1  0.322470  0.144186  0.462467  1
  Cu  Cu131  1  0.715219  0.149525  0.451725  1
  Cu  Cu132  1  0.108074  0.154836  0.440991  1
  Cu  Cu133  1  0.195796  0.277691  0.445307  1
  Cu  Cu134  1  0.588409  0.283057  0.434639  1
  Cu  Cu135  1  0.803062  0.272320  0.456169  1
  Cu  Cu136  1  0.195796  0.777691  0.445307  1
  Cu  Cu137  1  0.588409  0.783057  0.434639  1
  Cu  Cu138  1  0.803062  0.772320  0.456169  1
  Cu  Cu139  1  0.283480  0.400566  0.449674  1
  Cu  Cu140  1  0.676265  0.405899  0.439004  1
  Cu  Cu141  1  0.890841  0.395146  0.460502  1
  Cu  Cu142  1  0.283480  0.900566  0.449674  1
  Cu  Cu143  1  0.676265  0.905899  0.439004  1
  Cu  Cu144  1  0.890841  0.895146  0.460502  1
  Cu  Cu145  1  0.928482  0.503531  0.493815  1
  Cu  Cu146  1  0.321102  0.508982  0.482989  1
  Cu  Cu147  1  0.713923  0.514292  0.472271  1
  Cu  Cu148  1  0.928482  0.003531  0.493815  1
  Cu  Cu149  1  0.321102  0.008982  0.482989  1
  Cu  Cu150  1  0.713923  0.014292  0.472271  1
  Cu  Cu151  1  0.144351  0.628047  0.494822  1
  Cu  Cu152  1  0.536949  0.633479  0.484000  1
  Cu  Cu153  1  0.929854  0.638765  0.473289  1
  Cu  Cu154  1  0.144351  0.128047  0.494822  1
  Cu  Cu155  1  0.536949  0.133479  0.484000  1
  Cu  Cu156  1  0.929854  0.138765  0.473289  1
  Cu  Cu157  1  0.017625  0.261580  0.477670  1
  Cu  Cu158  1  0.410160  0.267019  0.466860  1
  Cu  Cu159  1  0.624748  0.256246  0.488409  1
  Cu  Cu160  1  0.017625  0.761580  0.477670  1
  Cu  Cu161  1  0.410160  0.767019  0.466860  1
  Cu  Cu162  1  0.624748  0.756246  0.488409  1
  Cu  Cu163  1  0.105293  0.384428  0.481990  1
  Cu  Cu164  1  0.497951  0.389828  0.471258  1
  Cu  Cu165  1  0.712542  0.379050  0.492799  1
  Cu  Cu166  1  0.105293  0.884428  0.481990  1
  Cu  Cu167  1  0.497951  0.889828  0.471258  1
  Cu  Cu168  1  0.712542  0.879050  0.492799  1
  Cu  Cu169  1  0.750139  0.487447  0.526055  1
  Cu  Cu170  1  0.142947  0.492843  0.515332  1
  Cu  Cu171  1  0.535584  0.498246  0.504517  1
  Cu  Cu172  1  0.750139  0.987447  0.526055  1
  Cu  Cu173  1  0.142947  0.992843  0.515332  1
  Cu  Cu174  1  0.535584  0.998246  0.504517  1
  Cu  Cu175  1  0.966141  0.611945  0.527094  1
  Cu  Cu176  1  0.358729  0.617376  0.516347  1
  Cu  Cu177  1  0.751541  0.622690  0.505529  1
  Cu  Cu178  1  0.966141  0.111945  0.527094  1
  Cu  Cu179  1  0.358729  0.117376  0.516347  1
  Cu  Cu180  1  0.751541  0.122690  0.505529  1
  Cu  Cu181  1  0.839372  0.245481  0.509950  1
  Cu  Cu182  1  0.232022  0.250899  0.499176  1
  Cu  Cu183  1  0.446448  0.240189  0.520683  1
  Cu  Cu184  1  0.839372  0.745481  0.509950  1
  Cu  Cu185  1  0.232022  0.750899  0.499176  1
  Cu  Cu186  1  0.446448  0.740189  0.520683  1
  Cu  Cu187  1  0.927113  0.368308  0.514339  1
  Cu  Cu188  1  0.319698  0.373758  0.503516  1
  Cu  Cu189  1  0.534240  0.362987  0.525042  1
  Cu  Cu190  1  0.927113  0.868308  0.514339  1
  Cu  Cu191  1  0.319698  0.873758  0.503516  1
  Cu  Cu192  1  0.534240  0.862987  0.525042  1
  Cu  Cu193  1  0.571721  0.471390  0.558298  1
  Cu  Cu194  1  0.964757  0.476731  0.547632  1
  Cu  Cu195  1  0.357335  0.482183  0.536830  1
  Cu  Cu196  1  0.571721  0.971390  0.558298  1
  Cu  Cu197  1  0.964757  0.976731  0.547632  1
  Cu  Cu198  1  0.357335  0.982183  0.536830  1
  Cu  Cu199  1  0.787807  0.595834  0.559303  1
  Cu  Cu200  1  0.180532  0.601269  0.548688  1
  Cu  Cu201  1  0.573176  0.606613  0.537830  1
  Cu  Cu202  1  0.787807  0.095834  0.559303  1
  Cu  Cu203  1  0.180532  0.101269  0.548688  1
  Cu  Cu204  1  0.573176  0.106613  0.537830  1
  Cu  Cu205  1  0.661053  0.229394  0.542186  1
  Cu  Cu206  1  0.053892  0.234780  0.531506  1
  Cu  Cu207  1  0.268242  0.224115  0.553048  1
  Cu  Cu208  1  0.661053  0.729394  0.542186  1
  Cu  Cu209  1  0.053892  0.734780  0.531506  1
  Cu  Cu210  1  0.268242  0.724115  0.553048  1
  Cu  Cu211  1  0.748881  0.352175  0.546602  1
  Cu  Cu212  1  0.141578  0.357640  0.535859  1
  Cu  Cu213  1  0.356023  0.346958  0.557324  1
  Cu  Cu214  1  0.748881  0.852175  0.546602  1
  Cu  Cu215  1  0.141578  0.857640  0.535859  1
  Cu  Cu216  1  0.356023  0.846958  0.557324  1
  Cu  Cu217  1  0.393402  0.455363  0.590679  1
  Cu  Cu218  1  0.786393  0.460582  0.579815  1
  Cu  Cu219  1  0.179238  0.466072  0.569195  1
  Cu  Cu220  1  0.393402  0.955363  0.590679  1
  Cu  Cu221  1  0.786393  0.960582  0.579815  1
  Cu  Cu222  1  0.179238  0.966072  0.569195  1
  Cu  Cu223  1  0.609344  0.579676  0.591616  1
  Cu  Cu224  1  1.002330  0.585163  0.580939  1
  Cu  Cu225  1  0.394783  0.590561  0.570237  1
  Cu  Cu226  1  0.609344  0.079676  0.591616  1
  Cu  Cu227  1  1.002330  0.085163  0.580939  1
  Cu  Cu228  1  0.394783  0.090561  0.570237  1
  Cu  Cu229  1  0.482659  0.213326  0.574482  1
  Cu  Cu230  1  0.875760  0.218627  0.563755  1
  Cu  Cu231  1  0.090185  0.208012  0.585393  1
  Cu  Cu232  1  0.482659  0.713326  0.574482  1
  Cu  Cu233  1  0.875760  0.718627  0.563755  1
  Cu  Cu234  1  0.090185  0.708012  0.585393  1
  Cu  Cu235  1  0.570596  0.336098  0.578815  1
  Cu  Cu236  1  0.963552  0.341502  0.568195  1
  Cu  Cu237  1  0.178094  0.330907  0.589739  1
  Cu  Cu238  1  0.570596  0.836098  0.578815  1
  Cu  Cu239  1  0.963552  0.841502  0.568195  1
  Cu  Cu240  1  0.178094  0.830907  0.589739  1
  Cu  Cu241  1  0.215398  0.439361  0.623154  1
  Cu  Cu242  1  0.607788  0.444486  0.612021  1
  Cu  Cu243  1  1.001183  0.450016  0.601463  1
  Cu  Cu244  1  0.215398  0.939361  0.623154  1
  Cu  Cu245  1  0.607788  0.944486  0.612021  1
  Cu  Cu246  1  1.001183  0.950016  0.601463  1
  Cu  Cu247  1  0.430653  0.563668  0.624100  1
  Cu  Cu248  1  0.823895  0.569002  0.613043  1
  Cu  Cu249  1  0.216352  0.574517  0.602620  1
  Cu  Cu250  1  0.430653  0.063668  0.624100  1
  Cu  Cu251  1  0.823895  0.069002  0.613043  1
  Cu  Cu252  1  0.216352  0.074517  0.602620  1
  Cu  Cu253  1  0.304259  0.197340  0.606963  1
  Cu  Cu254  1  0.697492  0.202492  0.595935  1
  Cu  Cu255  1  0.912332  0.191775  0.617624  1
  Cu  Cu256  1  0.304259  0.697340  0.606963  1
  Cu  Cu257  1  0.697492  0.702492  0.595935  1
  Cu  Cu258  1  0.912332  0.691775  0.617624  1
  Cu  Cu259  1  0.392450  0.320116  0.611104  1
  Cu  Cu260  1  0.785496  0.325243  0.600400  1
  Cu  Cu261  1  1.000549  0.314793  0.622070  1
  Cu  Cu262  1  0.392450  0.820116  0.611104  1
  Cu  Cu263  1  0.785496  0.825243  0.600400  1
  Cu  Cu264  1  1.000549  0.814793  0.622070  1
  Cu  Cu265  1  0.037260  0.423767  0.655405  1
  Cu  Cu266  1  0.429444  0.428309  0.644554  1
  Cu  Cu267  1  0.822944  0.433622  0.633486  1
  Cu  Cu268  1  0.037260  0.923767  0.655405  1
  Cu  Cu269  1  0.429444  0.928309  0.644554  1
  Cu  Cu270  1  0.822944  0.933622  0.633486  1
  Cu  Cu271  1  0.251708  0.548047  0.656567  1
  Cu  Cu272  1  0.645406  0.552541  0.645383  1
  Cu  Cu273  1  0.037820  0.558492  0.634927  1
  Cu  Cu274  1  0.251708  0.048047  0.656567  1
  Cu  Cu275  1  0.645406  0.052541  0.645383  1
  Cu  Cu276  1  0.037820  0.058492  0.634927  1
  Cu  Cu277  1  0.126135  0.181205  0.639438  1
  Cu  Cu278  1  0.519056  0.186305  0.628181  1
  Cu  Cu279  1  0.734298  0.175668  0.649678  1
  Cu  Cu280  1  0.126135  0.681205  0.639438  1
  Cu  Cu281  1  0.519056  0.686305  0.628181  1
  Cu  Cu282  1  0.734298  0.675668  0.649678  1
  Cu  Cu283  1  0.214945  0.304227  0.643723  1
  Cu  Cu284  1  0.607464  0.309102  0.632547  1
  Cu  Cu285  1  0.823071  0.298255  0.654176  1
  Cu  Cu286  1  0.214945  0.804227  0.643723  1
  Cu  Cu287  1  0.607464  0.809102  0.632547  1
  Cu  Cu288  1  0.823071  0.798255  0.654176  1
  Cu  Cu289  1  0.858437  0.406902  0.687171  1
  Cu  Cu290  1  0.252051  0.412248  0.677171  1
  Cu  Cu291  1  0.644521  0.417515  0.665564  1
  Cu  Cu292  1  0.858437  0.906902  0.687171  1
  Cu  Cu293  1  0.252051  0.912248  0.677171  1
  Cu  Cu294  1  0.644521  0.917515  0.665564  1
  Cu  Cu295  1  0.073100  0.532574  0.688977  1
  Cu  Cu296  1  0.467121  0.535762  0.677693  1
  Cu  Cu297  1  0.857886  0.542263  0.666790  1
  Cu  Cu298  1  0.073100  0.032574  0.688977  1
  Cu  Cu299  1  0.467121  0.035762  0.677693  1
  Cu  Cu300  1  0.857886  0.042263  0.666790  1
  Cu  Cu301  1  0.947903  0.164662  0.671764  1
  Cu  Cu302  1  0.340355  0.170590  0.660854  1
  Cu  Cu303  1  0.556977  0.159223  0.681597  1
  Cu  Cu304  1  0.947903  0.664662  0.671764  1
  Cu  Cu305  1  0.340355  0.670590  0.660854  1
  Cu  Cu306  1  0.556977  0.659223  0.681597  1
  Cu  Cu307  1  0.038298  0.288031  0.675871  1
  Cu  Cu308  1  0.429937  0.293084  0.664741  1
  Cu  Cu309  1  0.646078  0.282316  0.686197  1
  Cu  Cu310  1  0.038298  0.788031  0.675871  1
  Cu  Cu311  1  0.429937  0.793084  0.664741  1
  Cu  Cu312  1  0.646078  0.782316  0.686197  1
  Cu  Cu313  1  0.682013  0.389980  0.718275  1
  Cu  Cu314  1  0.072891  0.396371  0.708556  1
  Cu  Cu315  1  0.466074  0.401577  0.698554  1
  Cu  Cu316  1  0.682013  0.889980  0.718275  1
  Cu  Cu317  1  0.072891  0.896371  0.708556  1
  Cu  Cu318  1  0.466074  0.901577  0.698554  1
  Cu  Cu319  1  0.895051  0.514402  0.719109  1
  Cu  Cu320  1  0.289713  0.520880  0.709429  1
  Cu  Cu321  1  0.677895  0.526668  0.699718  1
  Cu  Cu322  1  0.895051  0.014402  0.719109  1
  Cu  Cu323  1  0.289713  0.020880  0.709429  1
  Cu  Cu324  1  0.677895  0.026668  0.699718  1
  Cu  Cu325  1  0.769930  0.149341  0.703678  1
  Cu  Cu326  1  0.162011  0.155463  0.693640  1
  Cu  Cu327  1  0.381584  0.142205  0.713434  1
  Cu  Cu328  1  0.769930  0.649341  0.703678  1
  Cu  Cu329  1  0.162011  0.655463  0.693640  1
  Cu  Cu330  1  0.381584  0.642205  0.713434  1
  Cu  Cu331  1  0.860875  0.271745  0.707591  1
  Cu  Cu332  1  0.253025  0.277633  0.697786  1
  Cu  Cu333  1  0.469339  0.264958  0.717292  1
  Cu  Cu334  1  0.860875  0.771745  0.707591  1
  Cu  Cu335  1  0.253025  0.777633  0.697786  1
  Cu  Cu336  1  0.469339  0.764958  0.717292  1
