# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   13.17209457
_cell_length_b   11.37088352
_cell_length_c   46.56473954
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   125.39256530
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu
_chemical_formula_sum   Cu216
_cell_volume   5685.54334565
_cell_formula_units_Z   216
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  0.390959  0.223659  0.290211  1
  Cu  Cu2  1  0.057626  0.223659  0.290211  1
  Cu  Cu3  1  0.988355  0.748598  0.278531  1
  Cu  Cu4  1  0.724293  0.223659  0.290211  1
  Cu  Cu5  1  0.655022  0.748598  0.278531  1
  Cu  Cu6  1  0.321689  0.748598  0.278531  1
  Cu  Cu7  1  0.206646  0.956492  0.295212  1
  Cu  Cu8  1  0.873313  0.956492  0.295212  1
  Cu  Cu9  1  0.804076  0.487359  0.284124  1
  Cu  Cu10  1  0.539979  0.956492  0.295212  1
  Cu  Cu11  1  0.470743  0.487359  0.284124  1
  Cu  Cu12  1  0.137409  0.487359  0.284124  1
  Cu  Cu13  1  0.196414  0.167328  0.313446  1
  Cu  Cu14  1  0.863080  0.167328  0.313446  1
  Cu  Cu15  1  0.791498  0.691404  0.301409  1
  Cu  Cu16  1  0.529747  0.167328  0.313446  1
  Cu  Cu17  1  0.458165  0.691404  0.301409  1
  Cu  Cu18  1  0.124832  0.691404  0.301409  1
  Cu  Cu19  1  0.012842  0.905094  0.319671  1
  Cu  Cu20  1  0.679509  0.905094  0.319671  1
  Cu  Cu21  1  0.608026  0.429449  0.307252  1
  Cu  Cu22  1  0.346175  0.905094  0.319671  1
  Cu  Cu23  1  0.274693  0.429449  0.307252  1
  Cu  Cu24  1  0.941360  0.429449  0.307252  1
  Cu  Cu25  1  1.000726  0.110429  0.338916  1
  Cu  Cu26  1  0.667393  0.110429  0.338916  1
  Cu  Cu27  1  0.598773  0.638972  0.326951  1
  Cu  Cu28  1  0.334059  0.110429  0.338916  1
  Cu  Cu29  1  0.265439  0.638972  0.326951  1
  Cu  Cu30  1  0.932106  0.638972  0.326951  1
  Cu  Cu31  1  0.815701  0.846599  0.344633  1
  Cu  Cu32  1  0.482367  0.846599  0.344633  1
  Cu  Cu33  1  0.413413  0.374628  0.332946  1
  Cu  Cu34  1  0.149034  0.846599  0.344633  1
  Cu  Cu35  1  0.080080  0.374628  0.332946  1
  Cu  Cu36  1  0.746747  0.374628  0.332946  1
  Cu  Cu37  1  0.807093  0.055044  0.363729  1
  Cu  Cu38  1  0.473759  0.055044  0.363729  1
  Cu  Cu39  1  0.403930  0.581711  0.351448  1
  Cu  Cu40  1  0.140426  0.055044  0.363729  1
  Cu  Cu41  1  0.070596  0.581711  0.351448  1
  Cu  Cu42  1  0.737263  0.581711  0.351448  1
  Cu  Cu43  1  0.620839  0.791726  0.370064  1
  Cu  Cu44  1  0.287505  0.791726  0.370064  1
  Cu  Cu45  1  0.217716  0.318317  0.357491  1
  Cu  Cu46  1  0.954172  0.791726  0.370064  1
  Cu  Cu47  1  0.884383  0.318317  0.357491  1
  Cu  Cu48  1  0.551050  0.318317  0.357491  1
  Cu  Cu49  1  0.612354  0.998941  0.388898  1
  Cu  Cu50  1  0.279021  0.998941  0.388898  1
  Cu  Cu51  1  0.209907  0.526733  0.376711  1
  Cu  Cu52  1  0.945687  0.998941  0.388898  1
  Cu  Cu53  1  0.876574  0.526733  0.376711  1
  Cu  Cu54  1  0.543241  0.526733  0.376711  1
  Cu  Cu55  1  0.425854  0.735371  0.395060  1
  Cu  Cu56  1  0.092521  0.735371  0.395060  1
  Cu  Cu57  1  0.022911  0.262756  0.382810  1
  Cu  Cu58  1  0.759188  0.735371  0.395060  1
  Cu  Cu59  1  0.689577  0.262756  0.382810  1
  Cu  Cu60  1  0.356244  0.262756  0.382810  1
  Cu  Cu61  1  0.418072  0.943589  0.413976  1
  Cu  Cu62  1  0.084739  0.943589  0.413976  1
  Cu  Cu63  1  0.015228  0.470941  0.401566  1
  Cu  Cu64  1  0.751406  0.943589  0.413976  1
  Cu  Cu65  1  0.681895  0.470941  0.401566  1
  Cu  Cu66  1  0.348561  0.470941  0.401566  1
  Cu  Cu67  1  0.231249  0.679741  0.420225  1
  Cu  Cu68  1  0.897916  0.679741  0.420225  1
  Cu  Cu69  1  0.828361  0.207241  0.407749  1
  Cu  Cu70  1  0.564583  0.679741  0.420225  1
  Cu  Cu71  1  0.495028  0.207241  0.407749  1
  Cu  Cu72  1  0.161694  0.207241  0.407749  1
  Cu  Cu73  1  0.223446  0.887708  0.439027  1
  Cu  Cu74  1  0.890113  0.887708  0.439027  1
  Cu  Cu75  1  0.820705  0.415357  0.426659  1
  Cu  Cu76  1  0.556780  0.887708  0.439027  1
  Cu  Cu77  1  0.487371  0.415357  0.426659  1
  Cu  Cu78  1  0.154038  0.415357  0.426659  1
  Cu  Cu79  1  0.036623  0.623906  0.445263  1
  Cu  Cu80  1  0.703290  0.623906  0.445263  1
  Cu  Cu81  1  0.633783  0.151480  0.432844  1
  Cu  Cu82  1  0.369956  0.623906  0.445263  1
  Cu  Cu83  1  0.300450  0.151480  0.432844  1
  Cu  Cu84  1  0.967116  0.151480  0.432844  1
  Cu  Cu85  1  0.028970  0.832087  0.464102  1
  Cu  Cu86  1  0.695637  0.832087  0.464102  1
  Cu  Cu87  1  0.626182  0.359720  0.451655  1
  Cu  Cu88  1  0.362303  0.832087  0.464102  1
  Cu  Cu89  1  0.292848  0.359720  0.451655  1
  Cu  Cu90  1  0.959515  0.359720  0.451655  1
  Cu  Cu91  1  0.842074  0.568213  0.470350  1
  Cu  Cu92  1  0.508741  0.568213  0.470350  1
  Cu  Cu93  1  0.439268  0.095886  0.457884  1
  Cu  Cu94  1  0.175408  0.568213  0.470350  1
  Cu  Cu95  1  0.105935  0.095886  0.457884  1
  Cu  Cu96  1  0.772602  0.095886  0.457884  1
  Cu  Cu97  1  0.834422  0.776353  0.489155  1
  Cu  Cu98  1  0.501089  0.776353  0.489155  1
  Cu  Cu99  1  0.431638  0.304037  0.476711  1
  Cu  Cu100  1  0.167756  0.776353  0.489155  1
  Cu  Cu101  1  0.098305  0.304037  0.476711  1
  Cu  Cu102  1  0.764972  0.304037  0.476711  1
  Cu  Cu103  1  0.647521  0.512493  0.495400  1
  Cu  Cu104  1  0.314188  0.512493  0.495400  1
  Cu  Cu105  1  0.244720  0.040154  0.482940  1
  Cu  Cu106  1  0.980855  0.512493  0.495400  1
  Cu  Cu107  1  0.911387  0.040154  0.482940  1
  Cu  Cu108  1  0.578054  0.040154  0.482940  1
  Cu  Cu109  1  0.639915  0.720702  0.514218  1
  Cu  Cu110  1  0.306581  0.720702  0.514218  1
  Cu  Cu111  1  0.237114  0.248363  0.501758  1
  Cu  Cu112  1  0.973248  0.720702  0.514218  1
  Cu  Cu113  1  0.903780  0.248363  0.501758  1
  Cu  Cu114  1  0.570447  0.248363  0.501758  1
  Cu  Cu115  1  0.452997  0.456820  0.520447  1
  Cu  Cu116  1  0.119663  0.456820  0.520447  1
  Cu  Cu117  1  0.050213  0.984504  0.508003  1
  Cu  Cu118  1  0.786330  0.456820  0.520447  1
  Cu  Cu119  1  0.716879  0.984504  0.508003  1
  Cu  Cu120  1  0.383546  0.984504  0.508003  1
  Cu  Cu121  1  0.445367  0.664971  0.539274  1
  Cu  Cu122  1  0.112033  0.664971  0.539274  1
  Cu  Cu123  1  0.042561  0.192644  0.526808  1
  Cu  Cu124  1  0.778700  0.664971  0.539274  1
  Cu  Cu125  1  0.709227  0.192644  0.526808  1
  Cu  Cu126  1  0.375894  0.192644  0.526808  1
  Cu  Cu127  1  0.258453  0.401137  0.545503  1
  Cu  Cu128  1  0.925120  0.401137  0.545503  1
  Cu  Cu129  1  0.855665  0.928770  0.533056  1
  Cu  Cu130  1  0.591787  0.401137  0.545503  1
  Cu  Cu131  1  0.522332  0.928770  0.533056  1
  Cu  Cu132  1  0.188998  0.928770  0.533056  1
  Cu  Cu133  1  0.250852  0.609377  0.564314  1
  Cu  Cu134  1  0.917518  0.609377  0.564314  1
  Cu  Cu135  1  0.848012  0.136951  0.551895  1
  Cu  Cu136  1  0.584185  0.609377  0.564314  1
  Cu  Cu137  1  0.514679  0.136951  0.551895  1
  Cu  Cu138  1  0.181345  0.136951  0.551895  1
  Cu  Cu139  1  0.063930  0.345500  0.570499  1
  Cu  Cu140  1  0.730597  0.345500  0.570499  1
  Cu  Cu141  1  0.661189  0.873149  0.558131  1
  Cu  Cu142  1  0.397263  0.345500  0.570499  1
  Cu  Cu143  1  0.327855  0.873149  0.558131  1
  Cu  Cu144  1  0.994522  0.873149  0.558131  1
  Cu  Cu145  1  0.056274  0.553616  0.589409  1
  Cu  Cu146  1  0.722941  0.553616  0.589409  1
  Cu  Cu147  1  0.653386  0.081116  0.576933  1
  Cu  Cu148  1  0.389607  0.553616  0.589409  1
  Cu  Cu149  1  0.320052  0.081116  0.576933  1
  Cu  Cu150  1  0.986719  0.081116  0.576933  1
  Cu  Cu151  1  0.869407  0.289916  0.595592  1
  Cu  Cu152  1  0.536074  0.289916  0.595592  1
  Cu  Cu153  1  0.466563  0.817268  0.583183  1
  Cu  Cu154  1  0.202740  0.289916  0.595592  1
  Cu  Cu155  1  0.133229  0.817268  0.583183  1
  Cu  Cu156  1  0.799896  0.817268  0.583183  1
  Cu  Cu157  1  0.861724  0.498101  0.614348  1
  Cu  Cu158  1  0.528391  0.498101  0.614348  1
  Cu  Cu159  1  0.458781  0.025486  0.602098  1
  Cu  Cu160  1  0.195058  0.498101  0.614348  1
  Cu  Cu161  1  0.125447  0.025486  0.602098  1
  Cu  Cu162  1  0.792114  0.025486  0.602098  1
  Cu  Cu163  1  0.674727  0.234124  0.620447  1
  Cu  Cu164  1  0.341394  0.234124  0.620447  1
  Cu  Cu165  1  0.272281  0.761916  0.608261  1
  Cu  Cu166  1  0.008061  0.234124  0.620447  1
  Cu  Cu167  1  0.938948  0.761916  0.608261  1
  Cu  Cu168  1  0.605614  0.761916  0.608261  1
  Cu  Cu169  1  0.666919  0.442540  0.639667  1
  Cu  Cu170  1  0.333585  0.442540  0.639667  1
  Cu  Cu171  1  0.263796  0.969131  0.627094  1
  Cu  Cu172  1  1.000252  0.442540  0.639667  1
  Cu  Cu173  1  0.930463  0.969131  0.627094  1
  Cu  Cu174  1  0.597130  0.969131  0.627094  1
  Cu  Cu175  1  0.480705  0.179146  0.645710  1
  Cu  Cu176  1  0.147372  0.179146  0.645710  1
  Cu  Cu177  1  0.077542  0.705812  0.633429  1
  Cu  Cu178  1  0.814039  0.179146  0.645710  1
  Cu  Cu179  1  0.744209  0.705812  0.633429  1
  Cu  Cu180  1  0.410876  0.705812  0.633429  1
  Cu  Cu181  1  0.471222  0.386228  0.664212  1
  Cu  Cu182  1  0.137888  0.386228  0.664212  1
  Cu  Cu183  1  0.068934  0.914258  0.652525  1
  Cu  Cu184  1  0.804555  0.386228  0.664212  1
  Cu  Cu185  1  0.735601  0.914258  0.652525  1
  Cu  Cu186  1  0.402268  0.914258  0.652525  1
  Cu  Cu187  1  0.285862  0.121885  0.670207  1
  Cu  Cu188  1  0.952529  0.121885  0.670207  1
  Cu  Cu189  1  0.883909  0.650428  0.658242  1
  Cu  Cu190  1  0.619196  0.121885  0.670207  1
  Cu  Cu191  1  0.550576  0.650428  0.658242  1
  Cu  Cu192  1  0.217242  0.650428  0.658242  1
  Cu  Cu193  1  0.276608  0.331407  0.689906  1
  Cu  Cu194  1  0.943275  0.331407  0.689906  1
  Cu  Cu195  1  0.871793  0.855763  0.677487  1
  Cu  Cu196  1  0.609942  0.331407  0.689906  1
  Cu  Cu197  1  0.538460  0.855763  0.677487  1
  Cu  Cu198  1  0.205126  0.855763  0.677487  1
  Cu  Cu199  1  0.093137  0.069452  0.695749  1
  Cu  Cu200  1  0.759803  0.069452  0.695749  1
  Cu  Cu201  1  0.688221  0.593529  0.683713  1
  Cu  Cu202  1  0.426470  0.069452  0.695749  1
  Cu  Cu203  1  0.354888  0.593529  0.683713  1
  Cu  Cu204  1  0.021555  0.593529  0.683713  1
  Cu  Cu205  1  0.080559  0.273498  0.713034  1
  Cu  Cu206  1  0.747226  0.273498  0.713034  1
  Cu  Cu207  1  0.677989  0.804365  0.701946  1
  Cu  Cu208  1  0.413892  0.273498  0.713034  1
  Cu  Cu209  1  0.344655  0.804365  0.701946  1
  Cu  Cu210  1  0.011322  0.804365  0.701946  1
  Cu  Cu211  1  0.896279  0.012259  0.718627  1
  Cu  Cu212  1  0.562946  0.012259  0.718627  1
  Cu  Cu213  1  0.493675  0.537198  0.706947  1
  Cu  Cu214  1  0.229613  0.012259  0.718627  1
  Cu  Cu215  1  0.160342  0.537198  0.706947  1
  Cu  Cu216  1  0.827009  0.537198  0.706947  1
