# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.44226356
_cell_length_b   10.97148893
_cell_length_c   50.23615004
_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   Cu84
_cell_volume   1897.25644798
_cell_formula_units_Z   84
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  0.507243  0.009243  0.327101  1
  Cu  Cu2  1  0.507243  0.711480  0.306344  1
  Cu  Cu3  1  0.507243  0.411113  0.283295  1
  Cu  Cu4  1  1.007243  0.263292  0.274536  1
  Cu  Cu5  1  1.007243  0.861119  0.316717  1
  Cu  Cu6  1  1.007243  0.558761  0.294644  1
  Cu  Cu7  1  1.007243  0.058941  0.293353  1
  Cu  Cu8  1  1.007243  0.761303  0.273771  1
  Cu  Cu9  1  1.007243  0.359630  0.316709  1
  Cu  Cu10  1  0.507243  0.207908  0.305004  1
  Cu  Cu11  1  0.507243  0.909019  0.283651  1
  Cu  Cu12  1  0.507243  0.614410  0.264337  1
  Cu  Cu13  1  0.507243  0.907590  0.394402  1
  Cu  Cu14  1  0.507243  0.607960  0.372001  1
  Cu  Cu15  1  0.507243  0.307643  0.349395  1
  Cu  Cu16  1  1.007243  0.157904  0.337872  1
  Cu  Cu17  1  1.007243  0.757817  0.383257  1
  Cu  Cu18  1  1.007243  0.458124  0.360822  1
  Cu  Cu19  1  1.007243  0.959079  0.360859  1
  Cu  Cu20  1  1.007243  0.659200  0.338728  1
  Cu  Cu21  1  1.007243  0.256915  0.382807  1
  Cu  Cu22  1  0.507243  0.107820  0.371696  1
  Cu  Cu23  1  0.507243  0.809793  0.350021  1
  Cu  Cu24  1  0.507243  0.509156  0.327374  1
  Cu  Cu25  1  0.507243  0.804523  0.461181  1
  Cu  Cu26  1  0.507243  0.505178  0.438797  1
  Cu  Cu27  1  0.507243  0.206122  0.416418  1
  Cu  Cu28  1  1.007243  0.056920  0.405393  1
  Cu  Cu29  1  1.007243  0.654865  0.450007  1
  Cu  Cu30  1  1.007243  0.355537  0.427570  1
  Cu  Cu31  1  1.007243  0.855989  0.427787  1
  Cu  Cu32  1  1.007243  0.556506  0.405394  1
  Cu  Cu33  1  1.007243  0.155069  0.449981  1
  Cu  Cu34  1  0.507243  0.005606  0.438905  1
  Cu  Cu35  1  0.507243  0.706263  0.416603  1
  Cu  Cu36  1  0.507243  0.406622  0.394124  1
  Cu  Cu37  1  0.507243  0.702015  0.528114  1
  Cu  Cu38  1  0.507243  0.402908  0.505749  1
  Cu  Cu39  1  0.507243  0.103774  0.483455  1
  Cu  Cu40  1  1.007243  0.954167  0.472329  1
  Cu  Cu41  1  1.007243  0.552491  0.516941  1
  Cu  Cu42  1  1.007243  0.253339  0.494585  1
  Cu  Cu43  1  1.007243  0.753186  0.494620  1
  Cu  Cu44  1  1.007243  0.454034  0.472264  1
  Cu  Cu45  1  1.007243  0.052358  0.516876  1
  Cu  Cu46  1  0.507243  0.902751  0.505750  1
  Cu  Cu47  1  0.507243  0.603617  0.483456  1
  Cu  Cu48  1  0.507243  0.304510  0.461091  1
  Cu  Cu49  1  0.507243  0.599903  0.595081  1
  Cu  Cu50  1  0.507243  0.300262  0.572602  1
  Cu  Cu51  1  0.507243  1.000919  0.550300  1
  Cu  Cu52  1  1.007243  0.851456  0.539224  1
  Cu  Cu53  1  1.007243  0.450018  0.583810  1
  Cu  Cu54  1  1.007243  0.150536  0.561418  1
  Cu  Cu55  1  1.007243  0.650987  0.561635  1
  Cu  Cu56  1  1.007243  0.351660  0.539198  1
  Cu  Cu57  1  1.007243  0.949605  0.583812  1
  Cu  Cu58  1  0.507243  0.800403  0.572787  1
  Cu  Cu59  1  0.507243  0.501347  0.550407  1
  Cu  Cu60  1  0.507243  0.202002  0.528024  1
  Cu  Cu61  1  0.507243  0.497369  0.661831  1
  Cu  Cu62  1  0.507243  0.196732  0.639183  1
  Cu  Cu63  1  0.507243  0.898705  0.617509  1
  Cu  Cu64  1  1.007243  0.749610  0.606398  1
  Cu  Cu65  1  1.007243  0.347325  0.650476  1
  Cu  Cu66  1  1.007243  0.047446  0.628346  1
  Cu  Cu67  1  1.007243  0.548401  0.628383  1
  Cu  Cu68  1  1.007243  0.248708  0.605948  1
  Cu  Cu69  1  1.007243  0.848621  0.651333  1
  Cu  Cu70  1  0.507243  0.698882  0.639810  1
  Cu  Cu71  1  0.507243  0.398565  0.617204  1
  Cu  Cu72  1  0.507243  0.098935  0.594803  1
  Cu  Cu73  1  0.507243  0.392115  0.724868  1
  Cu  Cu74  1  0.507243  0.097506  0.705554  1
  Cu  Cu75  1  0.507243  0.798617  0.684201  1
  Cu  Cu76  1  1.007243  0.646894  0.672496  1
  Cu  Cu77  1  1.007243  0.245222  0.715434  1
  Cu  Cu78  1  1.007243  0.947584  0.695852  1
  Cu  Cu79  1  1.007243  0.447764  0.694561  1
  Cu  Cu80  1  1.007243  0.145406  0.672488  1
  Cu  Cu81  1  1.007243  0.743233  0.714669  1
  Cu  Cu82  1  0.507243  0.595412  0.705910  1
  Cu  Cu83  1  0.507243  0.295045  0.682861  1
  Cu  Cu84  1  0.507243  0.997282  0.662104  1
