# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.42328667
_cell_length_b   11.04175820
_cell_length_c   47.22969698
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu
_chemical_formula_sum   Cu168
_cell_volume   4392.7346849
_cell_formula_units_Z   168
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  0.500525  0.632762  0.297083  1
  Cu  Cu2  1  0.501837  0.418894  0.277316  1
  Cu  Cu3  1  0.500853  0.027896  0.287111  1
  Cu  Cu4  1  0.250979  0.375046  0.303748  1
  Cu  Cu5  1  0.250979  0.164446  0.283484  1
  Cu  Cu6  1  0.250979  0.769792  0.293772  1
  Cu  Cu7  1  0.001434  0.632762  0.297083  1
  Cu  Cu8  1  1.000122  0.418894  0.277316  1
  Cu  Cu9  1  0.001106  0.027896  0.287111  1
  Cu  Cu10  1  0.750979  0.498544  0.300388  1
  Cu  Cu11  1  0.750979  0.287881  0.280267  1
  Cu  Cu12  1  0.750979  0.892977  0.290704  1
  Cu  Cu13  1  0.502231  0.448608  0.329363  1
  Cu  Cu14  1  0.500682  0.237305  0.307916  1
  Cu  Cu15  1  0.500956  0.843249  0.318126  1
  Cu  Cu16  1  0.250979  0.188000  0.336129  1
  Cu  Cu17  1  0.250979  0.979764  0.314442  1
  Cu  Cu18  1  0.250979  0.583115  0.324032  1
  Cu  Cu19  1  0.999728  0.448608  0.329363  1
  Cu  Cu20  1  0.001277  0.237305  0.307916  1
  Cu  Cu21  1  0.001003  0.843249  0.318126  1
  Cu  Cu22  1  0.750979  0.314913  0.332580  1
  Cu  Cu23  1  0.750979  0.101829  0.311227  1
  Cu  Cu24  1  0.750979  0.707940  0.321971  1
  Cu  Cu25  1  0.500986  0.264284  0.361565  1
  Cu  Cu26  1  0.500991  0.053441  0.339788  1
  Cu  Cu27  1  0.500424  0.659318  0.350252  1
  Cu  Cu28  1  0.250979  1.002634  0.368367  1
  Cu  Cu29  1  0.250979  0.792593  0.346416  1
  Cu  Cu30  1  0.250979  0.398408  0.357461  1
  Cu  Cu31  1  1.000973  0.264284  0.361565  1
  Cu  Cu32  1  1.000968  0.053441  0.339788  1
  Cu  Cu33  1  0.001535  0.659318  0.350252  1
  Cu  Cu34  1  0.750979  0.131066  0.364968  1
  Cu  Cu35  1  0.750979  0.919598  0.343293  1
  Cu  Cu36  1  0.750979  0.526160  0.354281  1
  Cu  Cu37  1  0.500959  0.079917  0.393662  1
  Cu  Cu38  1  0.500889  0.869328  0.372013  1
  Cu  Cu39  1  0.501013  0.475109  0.382985  1
  Cu  Cu40  1  0.250979  0.818068  0.400531  1
  Cu  Cu41  1  0.250979  0.608055  0.378705  1
  Cu  Cu42  1  0.250979  0.213177  0.389968  1
  Cu  Cu43  1  0.001000  0.079917  0.393662  1
  Cu  Cu44  1  0.001070  0.869328  0.372013  1
  Cu  Cu45  1  1.000946  0.475109  0.382985  1
  Cu  Cu46  1  0.750979  0.947037  0.397244  1
  Cu  Cu47  1  0.750979  0.736388  0.375723  1
  Cu  Cu48  1  0.750979  0.342018  0.386549  1
  Cu  Cu49  1  0.500950  0.895700  0.425892  1
  Cu  Cu50  1  0.500911  0.685316  0.404311  1
  Cu  Cu51  1  0.501003  0.290635  0.415259  1
  Cu  Cu52  1  0.250979  0.633870  0.432844  1
  Cu  Cu53  1  0.250979  0.423647  0.411387  1
  Cu  Cu54  1  0.250979  0.028532  0.422221  1
  Cu  Cu55  1  0.001009  0.895700  0.425892  1
  Cu  Cu56  1  0.001048  0.685316  0.404311  1
  Cu  Cu57  1  1.000956  0.290635  0.415259  1
  Cu  Cu58  1  0.750979  0.763038  0.429620  1
  Cu  Cu59  1  0.750979  0.552568  0.408166  1
  Cu  Cu60  1  0.750979  0.157752  0.418828  1
  Cu  Cu61  1  0.500961  0.711567  0.458228  1
  Cu  Cu62  1  0.500976  0.501171  0.436764  1
  Cu  Cu63  1  0.500980  0.106261  0.447478  1
  Cu  Cu64  1  0.250979  0.449642  0.465294  1
  Cu  Cu65  1  0.250979  0.239130  0.443787  1
  Cu  Cu66  1  0.250979  0.844218  0.454470  1
  Cu  Cu67  1  0.000998  0.711567  0.458228  1
  Cu  Cu68  1  0.000983  0.501171  0.436764  1
  Cu  Cu69  1  1.000979  0.106261  0.447478  1
  Cu  Cu70  1  0.750979  0.578901  0.461997  1
  Cu  Cu71  1  0.750979  0.368350  0.440427  1
  Cu  Cu72  1  0.750979  0.973521  0.451143  1
  Cu  Cu73  1  0.500981  0.527379  0.490596  1
  Cu  Cu74  1  0.500985  0.316844  0.469052  1
  Cu  Cu75  1  0.500978  0.922001  0.479763  1
  Cu  Cu76  1  0.250979  0.265335  0.497626  1
  Cu  Cu77  1  0.250979  0.054745  0.476060  1
  Cu  Cu78  1  0.250979  0.660045  0.486808  1
  Cu  Cu79  1  1.000978  0.527379  0.490596  1
  Cu  Cu80  1  1.000974  0.316844  0.469052  1
  Cu  Cu81  1  0.000981  0.922001  0.479763  1
  Cu  Cu82  1  0.750979  0.394608  0.494273  1
  Cu  Cu83  1  0.750979  0.184050  0.472701  1
  Cu  Cu84  1  0.750979  0.789345  0.483518  1
  Cu  Cu85  1  0.500994  0.343098  0.522874  1
  Cu  Cu86  1  0.500989  0.132522  0.501308  1
  Cu  Cu87  1  0.500982  0.737815  0.512127  1
  Cu  Cu88  1  0.250979  0.081026  0.529882  1
  Cu  Cu89  1  0.250979  0.870469  0.508342  1
  Cu  Cu90  1  0.250979  0.475887  0.519182  1
  Cu  Cu91  1  1.000965  0.343098  0.522874  1
  Cu  Cu92  1  1.000970  0.132522  0.501308  1
  Cu  Cu93  1  1.000977  0.737815  0.512127  1
  Cu  Cu94  1  0.750979  0.210258  0.526561  1
  Cu  Cu95  1  0.750979  0.999766  0.505041  1
  Cu  Cu96  1  0.750979  0.605118  0.515852  1
  Cu  Cu97  1  0.501010  0.158767  0.555130  1
  Cu  Cu98  1  0.500994  0.948234  0.533626  1
  Cu  Cu99  1  0.500990  0.553624  0.544462  1
  Cu  Cu100  1  0.250979  0.896751  0.562166  1
  Cu  Cu101  1  0.250979  0.686324  0.540720  1
  Cu  Cu102  1  0.250979  0.291698  0.551463  1
  Cu  Cu103  1  1.000949  0.158767  0.555130  1
  Cu  Cu104  1  1.000965  0.948234  0.533626  1
  Cu  Cu105  1  1.000969  0.553624  0.544462  1
  Cu  Cu106  1  0.750979  0.025871  0.558945  1
  Cu  Cu107  1  0.750979  0.815525  0.537438  1
  Cu  Cu108  1  0.750979  0.420779  0.548122  1
  Cu  Cu109  1  0.501021  0.974433  0.587475  1
  Cu  Cu110  1  0.500993  0.764038  0.566049  1
  Cu  Cu111  1  0.501018  0.369331  0.576710  1
  Cu  Cu112  1  0.250979  0.712719  0.594639  1
  Cu  Cu113  1  0.250979  0.502295  0.573076  1
  Cu  Cu114  1  0.250979  0.107493  0.583652  1
  Cu  Cu115  1  1.000938  0.974433  0.587475  1
  Cu  Cu116  1  1.000965  0.764038  0.566049  1
  Cu  Cu117  1  1.000941  0.369331  0.576710  1
  Cu  Cu118  1  0.750979  0.841536  0.591418  1
  Cu  Cu119  1  0.750979  0.631235  0.569731  1
  Cu  Cu120  1  0.750979  0.236281  0.580412  1
  Cu  Cu121  1  0.500996  0.790308  0.620039  1
  Cu  Cu122  1  0.500974  0.579852  0.598362  1
  Cu  Cu123  1  0.501082  0.184912  0.608948  1
  Cu  Cu124  1  0.250979  0.528956  0.627018  1
  Cu  Cu125  1  0.250979  0.318358  0.605303  1
  Cu  Cu126  1  0.250979  0.923283  0.615877  1
  Cu  Cu127  1  1.000963  0.790308  0.620039  1
  Cu  Cu128  1  0.000985  0.579852  0.598362  1
  Cu  Cu129  1  1.000877  0.184912  0.608948  1
  Cu  Cu130  1  0.750979  0.657056  0.623615  1
  Cu  Cu131  1  0.750979  0.446765  0.601976  1
  Cu  Cu132  1  0.750979  0.051550  0.612880  1
  Cu  Cu133  1  0.501090  0.606330  0.652335  1
  Cu  Cu134  1  0.501023  0.395430  0.630557  1
  Cu  Cu135  1  0.501519  1.000336  0.641361  1
  Cu  Cu136  1  0.250979  0.345439  0.659282  1
  Cu  Cu137  1  0.250979  0.134683  0.637336  1
  Cu  Cu138  1  0.250979  0.739654  0.648635  1
  Cu  Cu139  1  1.000869  0.606330  0.652335  1
  Cu  Cu140  1  1.000936  0.395430  0.630557  1
  Cu  Cu141  1  1.000440  1.000336  0.641361  1
  Cu  Cu142  1  0.750979  0.472432  0.655885  1
  Cu  Cu143  1  0.750979  0.261969  0.634206  1
  Cu  Cu144  1  0.750979  0.866437  0.645594  1
  Cu  Cu145  1  0.500820  0.421784  0.684330  1
  Cu  Cu146  1  0.501197  0.210672  0.662878  1
  Cu  Cu147  1  0.499646  0.816933  0.674234  1
  Cu  Cu148  1  0.250979  0.162528  0.691162  1
  Cu  Cu149  1  0.250979  0.951730  0.669153  1
  Cu  Cu150  1  0.250979  0.558097  0.680862  1
  Cu  Cu151  1  0.001139  0.421784  0.684330  1
  Cu  Cu152  1  1.000762  0.210672  0.662878  1
  Cu  Cu153  1  0.002313  0.816933  0.674234  1
  Cu  Cu154  1  0.750979  0.287212  0.687819  1
  Cu  Cu155  1  0.750979  0.076414  0.666887  1
  Cu  Cu156  1  0.750979  0.680866  0.677566  1
  Cu  Cu157  1  0.500326  0.236551  0.715331  1
  Cu  Cu158  1  0.501596  0.025465  0.695266  1
  Cu  Cu159  1  0.501148  0.631296  0.704987  1
  Cu  Cu160  1  0.250979  0.978615  0.721196  1
  Cu  Cu161  1  0.250979  0.768202  0.701833  1
  Cu  Cu162  1  0.250979  0.372029  0.711799  1
  Cu  Cu163  1  0.001633  0.236551  0.715331  1
  Cu  Cu164  1  1.000363  0.025465  0.695266  1
  Cu  Cu165  1  1.000811  0.631296  0.704987  1
  Cu  Cu166  1  0.750979  0.107040  0.718796  1
  Cu  Cu167  1  0.750979  0.890915  0.698725  1
  Cu  Cu168  1  0.750979  0.497121  0.708516  1
