# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.75369549
_cell_length_b   12.85563896
_cell_length_c   49.57183944
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   92.15809664
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu
_chemical_formula_sum   Cu162
_cell_volume   4300.92661916
_cell_formula_units_Z   162
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  0.550355  0.175307  0.316405  1
  Cu  Cu2  1  0.529630  0.853065  0.300657  1
  Cu  Cu3  1  0.506187  0.531153  0.285182  1
  Cu  Cu4  1  0.883688  0.841973  0.316405  1
  Cu  Cu5  1  0.862963  0.519732  0.300657  1
  Cu  Cu6  1  0.217022  0.508640  0.316405  1
  Cu  Cu7  1  0.839521  0.197820  0.285182  1
  Cu  Cu8  1  0.196296  0.186398  0.300657  1
  Cu  Cu9  1  0.172854  0.864487  0.285182  1
  Cu  Cu10  1  0.639055  0.355373  0.298011  1
  Cu  Cu11  1  0.619670  0.032975  0.282887  1
  Cu  Cu12  1  0.659062  0.676022  0.313961  1
  Cu  Cu13  1  0.972388  0.022040  0.298011  1
  Cu  Cu14  1  0.953003  0.699642  0.282887  1
  Cu  Cu15  1  0.305721  0.688706  0.298011  1
  Cu  Cu16  1  0.992395  0.342689  0.313961  1
  Cu  Cu17  1  0.286337  0.366309  0.282887  1
  Cu  Cu18  1  0.325729  0.009355  0.313961  1
  Cu  Cu19  1  0.620756  0.136159  0.366577  1
  Cu  Cu20  1  0.598427  0.815097  0.349820  1
  Cu  Cu21  1  0.574625  0.494383  0.333247  1
  Cu  Cu22  1  0.954090  0.802826  0.366577  1
  Cu  Cu23  1  0.931760  0.481764  0.349820  1
  Cu  Cu24  1  0.287423  0.469493  0.366577  1
  Cu  Cu25  1  0.907958  0.161050  0.333247  1
  Cu  Cu26  1  0.265093  0.148430  0.349820  1
  Cu  Cu27  1  0.241291  0.827717  0.333247  1
  Cu  Cu28  1  0.705215  0.317137  0.347129  1
  Cu  Cu29  1  0.681733  0.997421  0.330868  1
  Cu  Cu30  1  0.726930  0.637644  0.363919  1
  Cu  Cu31  1  0.038549  0.983803  0.347129  1
  Cu  Cu32  1  0.015066  0.664088  0.330868  1
  Cu  Cu33  1  0.371882  0.650470  0.347129  1
  Cu  Cu34  1  0.060263  0.304311  0.363919  1
  Cu  Cu35  1  0.348400  0.330755  0.330868  1
  Cu  Cu36  1  0.393596  0.970978  0.363919  1
  Cu  Cu37  1  0.689953  0.097592  0.416715  1
  Cu  Cu38  1  0.667013  0.777009  0.399965  1
  Cu  Cu39  1  0.644053  0.456359  0.383232  1
  Cu  Cu40  1  0.023286  0.764259  0.416715  1
  Cu  Cu41  1  1.000347  0.443676  0.399965  1
  Cu  Cu42  1  0.356620  0.430926  0.416715  1
  Cu  Cu43  1  0.977386  0.123026  0.383232  1
  Cu  Cu44  1  0.333680  0.110343  0.399965  1
  Cu  Cu45  1  0.310719  0.789692  0.383232  1
  Cu  Cu46  1  0.772401  0.279017  0.397373  1
  Cu  Cu47  1  0.749585  0.958517  0.380670  1
  Cu  Cu48  1  0.795068  0.599533  0.414116  1
  Cu  Cu49  1  0.105735  0.945683  0.397373  1
  Cu  Cu50  1  0.082918  0.625184  0.380670  1
  Cu  Cu51  1  0.439068  0.612350  0.397373  1
  Cu  Cu52  1  0.128402  0.266200  0.414116  1
  Cu  Cu53  1  0.416251  0.291851  0.380670  1
  Cu  Cu54  1  0.461735  0.932866  0.414116  1
  Cu  Cu55  1  0.758583  0.059231  0.466872  1
  Cu  Cu56  1  0.735679  0.738691  0.450143  1
  Cu  Cu57  1  0.712833  0.418125  0.433414  1
  Cu  Cu58  1  0.091916  0.725898  0.466872  1
  Cu  Cu59  1  0.069012  0.405357  0.450143  1
  Cu  Cu60  1  0.425250  0.392565  0.466872  1
  Cu  Cu61  1  0.046167  0.084791  0.433414  1
  Cu  Cu62  1  0.402345  0.072024  0.450143  1
  Cu  Cu63  1  0.379500  0.751458  0.433414  1
  Cu  Cu64  1  0.840807  0.240665  0.447566  1
  Cu  Cu65  1  0.817964  0.920103  0.430824  1
  Cu  Cu66  1  0.863674  0.561212  0.464286  1
  Cu  Cu67  1  0.174141  0.907332  0.447566  1
  Cu  Cu68  1  0.151297  0.586769  0.430824  1
  Cu  Cu69  1  0.507474  0.573998  0.447566  1
  Cu  Cu70  1  0.197008  0.227879  0.464286  1
  Cu  Cu71  1  0.484631  0.253436  0.430824  1
  Cu  Cu72  1  0.530341  0.894546  0.464286  1
  Cu  Cu73  1  0.827163  0.020904  0.517048  1
  Cu  Cu74  1  0.804298  0.700347  0.500318  1
  Cu  Cu75  1  0.781431  0.379797  0.483596  1
  Cu  Cu76  1  0.160496  0.687570  0.517048  1
  Cu  Cu77  1  0.137631  0.367014  0.500318  1
  Cu  Cu78  1  0.493829  0.354237  0.517048  1
  Cu  Cu79  1  0.114764  0.046464  0.483596  1
  Cu  Cu80  1  0.470965  0.033680  0.500318  1
  Cu  Cu81  1  0.448098  0.713130  0.483596  1
  Cu  Cu82  1  0.909399  0.202320  0.497740  1
  Cu  Cu83  1  0.886535  0.881763  0.481009  1
  Cu  Cu84  1  0.932266  0.522870  0.514462  1
  Cu  Cu85  1  0.242733  0.868987  0.497740  1
  Cu  Cu86  1  0.219868  0.548430  0.481009  1
  Cu  Cu87  1  0.576066  0.535653  0.497740  1
  Cu  Cu88  1  0.265600  0.189537  0.514462  1
  Cu  Cu89  1  0.553201  0.215097  0.481009  1
  Cu  Cu90  1  0.598933  0.856203  0.514462  1
  Cu  Cu91  1  0.895734  0.982564  0.567233  1
  Cu  Cu92  1  0.872890  0.662002  0.550491  1
  Cu  Cu93  1  0.850023  0.341455  0.533771  1
  Cu  Cu94  1  0.229067  0.649231  0.567233  1
  Cu  Cu95  1  0.206224  0.328669  0.550491  1
  Cu  Cu96  1  0.562400  0.315898  0.567233  1
  Cu  Cu97  1  0.183357  0.008121  0.533771  1
  Cu  Cu98  1  0.539557  0.995335  0.550491  1
  Cu  Cu99  1  0.516690  0.674788  0.533771  1
  Cu  Cu100  1  0.978019  0.163976  0.547914  1
  Cu  Cu101  1  0.955115  0.843436  0.531186  1
  Cu  Cu102  1  1.000864  0.484543  0.564644  1
  Cu  Cu103  1  0.311352  0.830643  0.547914  1
  Cu  Cu104  1  0.288448  0.510103  0.531186  1
  Cu  Cu105  1  0.644686  0.497310  0.547914  1
  Cu  Cu106  1  0.334198  0.151209  0.564644  1
  Cu  Cu107  1  0.621781  0.176769  0.531186  1
  Cu  Cu108  1  0.667531  0.817876  0.564644  1
  Cu  Cu109  1  0.964113  0.944150  0.617387  1
  Cu  Cu110  1  0.941296  0.623650  0.600684  1
  Cu  Cu111  1  0.918629  0.303134  0.583941  1
  Cu  Cu112  1  0.297446  0.610816  0.617387  1
  Cu  Cu113  1  0.274630  0.290317  0.600684  1
  Cu  Cu114  1  0.630780  0.277483  0.617387  1
  Cu  Cu115  1  0.251962  0.969801  0.583941  1
  Cu  Cu116  1  0.607963  0.956984  0.600684  1
  Cu  Cu117  1  0.585296  0.636467  0.583941  1
  Cu  Cu118  1  0.046684  0.125658  0.598093  1
  Cu  Cu119  1  0.023745  0.805075  0.581342  1
  Cu  Cu120  1  0.069645  0.446308  0.614825  1
  Cu  Cu121  1  0.380018  0.792324  0.598093  1
  Cu  Cu122  1  0.357078  0.471741  0.581342  1
  Cu  Cu123  1  0.713351  0.458991  0.598093  1
  Cu  Cu124  1  0.402978  0.112975  0.614825  1
  Cu  Cu125  1  0.690411  0.138408  0.581342  1
  Cu  Cu126  1  0.736312  0.779641  0.614825  1
  Cu  Cu127  1  0.031964  0.905246  0.667190  1
  Cu  Cu128  1  0.008482  0.585530  0.650928  1
  Cu  Cu129  1  0.986768  0.265023  0.634139  1
  Cu  Cu130  1  0.365298  0.571912  0.667190  1
  Cu  Cu131  1  0.341816  0.252197  0.650928  1
  Cu  Cu132  1  0.698631  0.238579  0.667190  1
  Cu  Cu133  1  0.320101  0.931689  0.634139  1
  Cu  Cu134  1  0.675149  0.918864  0.650928  1
  Cu  Cu135  1  0.653435  0.598356  0.634139  1
  Cu  Cu136  1  0.115271  0.087570  0.648238  1
  Cu  Cu137  1  0.092941  0.766508  0.631481  1
  Cu  Cu138  1  0.139073  0.408284  0.664810  1
  Cu  Cu139  1  0.448604  0.754237  0.648238  1
  Cu  Cu140  1  0.426275  0.433174  0.631481  1
  Cu  Cu141  1  0.781938  0.420904  0.648238  1
  Cu  Cu142  1  0.472406  0.074950  0.664810  1
  Cu  Cu143  1  0.759608  0.099841  0.631481  1
  Cu  Cu144  1  0.805740  0.741617  0.664810  1
  Cu  Cu145  1  0.094028  0.869692  0.715171  1
  Cu  Cu146  1  0.074643  0.547294  0.700046  1
  Cu  Cu147  1  0.054636  0.226645  0.684097  1
  Cu  Cu148  1  0.427361  0.536358  0.715171  1
  Cu  Cu149  1  0.407976  0.213961  0.700046  1
  Cu  Cu150  1  0.760694  0.203025  0.715171  1
  Cu  Cu151  1  0.387969  0.893312  0.684097  1
  Cu  Cu152  1  0.741310  0.880628  0.700046  1
  Cu  Cu153  1  0.721302  0.559978  0.684097  1
  Cu  Cu154  1  0.184068  0.049602  0.697401  1
  Cu  Cu155  1  0.163342  0.727360  0.681653  1
  Cu  Cu156  1  0.207510  0.371514  0.712875  1
  Cu  Cu157  1  0.517401  0.716269  0.697401  1
  Cu  Cu158  1  0.496676  0.394027  0.681653  1
  Cu  Cu159  1  0.850735  0.382935  0.697401  1
  Cu  Cu160  1  0.540843  0.038180  0.712875  1
  Cu  Cu161  1  0.830009  0.060694  0.681653  1
  Cu  Cu162  1  0.874177  0.704847  0.712875  1
