# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.53738098
_cell_length_b   25.41697287
_cell_length_c   48.45487583
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   92.87096960
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu
_chemical_formula_sum   Cu120
_cell_volume   3121.055911
_cell_formula_units_Z   120
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  0.041143  0.119651  0.282557  1
  Cu  Cu2  1  0.206731  0.450455  0.296941  1
  Cu  Cu3  1  0.372801  0.782479  0.310877  1
  Cu  Cu4  1  0.581372  0.199949  0.300342  1
  Cu  Cu5  1  0.747191  0.531343  0.315390  1
  Cu  Cu6  1  0.416393  0.869770  0.286321  1
  Cu  Cu7  1  0.958088  0.952905  0.275274  1
  Cu  Cu8  1  0.124398  0.285886  0.289493  1
  Cu  Cu9  1  0.290080  0.617080  0.304394  1
  Cu  Cu10  1  0.997658  0.032310  0.306062  1
  Cu  Cu11  1  0.666761  0.370545  0.278795  1
  Cu  Cu12  1  0.832313  0.701514  0.293487  1
  Cu  Cu13  1  0.537647  0.112517  0.326905  1
  Cu  Cu14  1  0.703367  0.443731  0.341727  1
  Cu  Cu15  1  0.868806  0.774518  0.356556  1
  Cu  Cu16  1  0.077805  0.192792  0.345608  1
  Cu  Cu17  1  0.243457  0.523896  0.360633  1
  Cu  Cu18  1  0.912649  0.862244  0.331179  1
  Cu  Cu19  1  0.455112  0.947075  0.319680  1
  Cu  Cu20  1  0.620390  0.277885  0.334197  1
  Cu  Cu21  1  0.786060  0.609074  0.349122  1
  Cu  Cu22  1  0.494065  0.025142  0.352422  1
  Cu  Cu23  1  0.163116  0.363266  0.323039  1
  Cu  Cu24  1  0.328821  0.694564  0.337738  1
  Cu  Cu25  1  0.034020  0.105167  0.372313  1
  Cu  Cu26  1  0.199567  0.436146  0.387287  1
  Cu  Cu27  1  0.364992  0.766927  0.402340  1
  Cu  Cu28  1  0.574140  0.185417  0.391278  1
  Cu  Cu29  1  0.739665  0.516327  0.406303  1
  Cu  Cu30  1  0.408776  0.854503  0.376465  1
  Cu  Cu31  1  0.951488  0.939910  0.365063  1
  Cu  Cu32  1  0.116750  0.270586  0.379770  1
  Cu  Cu33  1  0.282289  0.601547  0.394728  1
  Cu  Cu34  1  0.990336  0.017690  0.398364  1
  Cu  Cu35  1  0.659400  0.355833  0.368425  1
  Cu  Cu36  1  0.824940  0.686822  0.383248  1
  Cu  Cu37  1  0.530352  0.097786  0.417776  1
  Cu  Cu38  1  0.695805  0.428630  0.432828  1
  Cu  Cu39  1  0.861217  0.759399  0.447960  1
  Cu  Cu40  1  0.070435  0.177976  0.436873  1
  Cu  Cu41  1  0.235894  0.508799  0.451903  1
  Cu  Cu42  1  0.905032  0.847040  0.421875  1
  Cu  Cu43  1  0.447688  0.932351  0.410410  1
  Cu  Cu44  1  0.613049  0.263170  0.425314  1
  Cu  Cu45  1  0.778521  0.594022  0.440296  1
  Cu  Cu46  1  0.486568  0.010157  0.444024  1
  Cu  Cu47  1  0.155684  0.348401  0.413828  1
  Cu  Cu48  1  0.321152  0.679260  0.428755  1
  Cu  Cu49  1  0.026622  0.090309  0.463275  1
  Cu  Cu50  1  0.192042  0.421109  0.478384  1
  Cu  Cu51  1  0.357459  0.751896  0.493517  1
  Cu  Cu52  1  0.566696  0.170482  0.482441  1
  Cu  Cu53  1  0.732130  0.501277  0.497470  1
  Cu  Cu54  1  0.401279  0.839552  0.467337  1
  Cu  Cu55  1  0.943920  0.924839  0.455825  1
  Cu  Cu56  1  0.109315  0.255695  0.470874  1
  Cu  Cu57  1  0.274761  0.586509  0.485866  1
  Cu  Cu58  1  0.982803  0.002634  0.489568  1
  Cu  Cu59  1  0.651945  0.340923  0.459315  1
  Cu  Cu60  1  0.817386  0.671735  0.474301  1
  Cu  Cu61  1  0.522871  0.082806  0.508793  1
  Cu  Cu62  1  0.688273  0.413577  0.523943  1
  Cu  Cu63  1  0.853712  0.744405  0.539036  1
  Cu  Cu64  1  0.062940  0.162965  0.527994  1
  Cu  Cu65  1  0.228369  0.493759  0.543003  1
  Cu  Cu66  1  0.897527  0.832063  0.512839  1
  Cu  Cu67  1  0.440155  0.917324  0.501284  1
  Cu  Cu68  1  0.605561  0.248187  0.516440  1
  Cu  Cu69  1  0.771005  0.579001  0.531430  1
  Cu  Cu70  1  0.479037  0.995114  0.535048  1
  Cu  Cu71  1  0.148189  0.333413  0.504849  1
  Cu  Cu72  1  0.313631  0.664224  0.519858  1
  Cu  Cu73  1  0.019106  0.075285  0.554331  1
  Cu  Cu74  1  0.184496  0.406030  0.569499  1
  Cu  Cu75  1  0.349982  0.736932  0.584511  1
  Cu  Cu76  1  0.559166  0.155422  0.573534  1
  Cu  Cu77  1  0.724607  0.486239  0.588490  1
  Cu  Cu78  1  0.393780  0.824578  0.558382  1
  Cu  Cu79  1  0.936387  0.909798  0.546789  1
  Cu  Cu80  1  0.101793  0.240655  0.562012  1
  Cu  Cu81  1  0.267258  0.571502  0.576985  1
  Cu  Cu82  1  0.975265  0.987589  0.580467  1
  Cu  Cu83  1  0.644417  0.325878  0.550417  1
  Cu  Cu84  1  0.809883  0.656719  0.565421  1
  Cu  Cu85  1  0.515317  0.067731  0.599917  1
  Cu  Cu86  1  0.680707  0.398460  0.615043  1
  Cu  Cu87  1  0.846317  0.729570  0.629922  1
  Cu  Cu88  1  0.055362  0.147828  0.619036  1
  Cu  Cu89  1  0.220857  0.478740  0.633899  1
  Cu  Cu90  1  0.890046  0.817115  0.603983  1
  Cu  Cu91  1  0.432605  0.902243  0.592364  1
  Cu  Cu92  1  0.598006  0.233095  0.607584  1
  Cu  Cu93  1  0.763507  0.563992  0.622522  1
  Cu  Cu94  1  0.471483  0.980048  0.625794  1
  Cu  Cu95  1  0.140628  0.318312  0.596020  1
  Cu  Cu96  1  0.306156  0.649247  0.611003  1
  Cu  Cu97  1  0.011496  0.060129  0.645653  1
  Cu  Cu98  1  0.176884  0.390829  0.660610  1
  Cu  Cu99  1  0.342330  0.721533  0.675084  1
  Cu  Cu100  1  0.551422  0.139969  0.664549  1
  Cu  Cu101  1  0.717133  0.471298  0.679297  1
  Cu  Cu102  1  0.386439  0.809902  0.649718  1
  Cu  Cu103  1  0.928772  0.894583  0.638119  1
  Cu  Cu104  1  0.094203  0.225503  0.653198  1
  Cu  Cu105  1  0.259807  0.556580  0.668138  1
  Cu  Cu106  1  0.967611  0.972333  0.670912  1
  Cu  Cu107  1  0.636808  0.310689  0.641698  1
  Cu  Cu108  1  0.802296  0.641493  0.656627  1
  Cu  Cu109  1  0.507341  0.051852  0.691396  1
  Cu  Cu110  1  0.673550  0.384168  0.705402  1
  Cu  Cu111  1  0.839514  0.715756  0.719556  1
  Cu  Cu112  1  0.047871  0.132902  0.708780  1
  Cu  Cu113  1  0.213560  0.464165  0.723530  1
  Cu  Cu114  1  0.881924  0.800892  0.694743  1
  Cu  Cu115  1  0.425033  0.887125  0.684021  1
  Cu  Cu116  1  0.590136  0.217403  0.697918  1
  Cu  Cu117  1  0.755954  0.548891  0.712831  1
  Cu  Cu118  1  0.463922  0.964982  0.715285  1
  Cu  Cu119  1  0.133060  0.303215  0.686951  1
  Cu  Cu120  1  0.298989  0.634854  0.701985  1
