# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.42565211
_cell_length_b   8.76576242
_cell_length_c   45.80313221
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   75.34117785
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu
_chemical_formula_sum   Cu64
_cell_volume   1719.05835044
_cell_formula_units_Z   64
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  0.809133  0.257724  0.295500  1
  Cu  Cu2  1  0.352698  0.502991  0.301825  1
  Cu  Cu3  1  0.051210  0.769941  0.282884  1
  Cu  Cu4  1  0.264088  0.012444  0.288903  1
  Cu  Cu5  1  0.319970  0.236473  0.321833  1
  Cu  Cu6  1  0.863567  0.482043  0.328281  1
  Cu  Cu7  1  0.564216  0.746727  0.308452  1
  Cu  Cu8  1  0.775378  0.991984  0.315238  1
  Cu  Cu9  1  0.832713  0.213930  0.349474  1
  Cu  Cu10  1  0.375789  0.457239  0.356280  1
  Cu  Cu11  1  0.076793  0.725069  0.336078  1
  Cu  Cu12  1  0.287574  0.968918  0.342680  1
  Cu  Cu13  1  0.344372  0.190677  0.377323  1
  Cu  Cu14  1  0.886309  0.435108  0.384153  1
  Cu  Cu15  1  0.588067  0.701668  0.363490  1
  Cu  Cu16  1  0.800605  0.946456  0.370589  1
  Cu  Cu17  1  0.855785  0.168224  0.405207  1
  Cu  Cu18  1  0.397290  0.412383  0.412119  1
  Cu  Cu19  1  0.099938  0.679147  0.391378  1
  Cu  Cu20  1  0.313556  0.923550  0.398365  1
  Cu  Cu21  1  0.367390  0.145350  0.433107  1
  Cu  Cu22  1  0.908603  0.389718  0.440041  1
  Cu  Cu23  1  0.611761  0.656602  0.419213  1
  Cu  Cu24  1  0.825797  0.901021  0.426267  1
  Cu  Cu25  1  0.878955  0.122683  0.461014  1
  Cu  Cu26  1  0.420020  0.366974  0.467948  1
  Cu  Cu27  1  0.123339  0.633938  0.447100  1
  Cu  Cu28  1  0.337733  0.878254  0.454126  1
  Cu  Cu29  1  0.390514  0.099920  0.488909  1
  Cu  Cu30  1  0.931500  0.344270  0.495852  1
  Cu  Cu31  1  0.634842  0.611235  0.474993  1
  Cu  Cu32  1  0.849465  0.855542  0.482008  1
  Cu  Cu33  1  0.902049  0.077184  0.516806  1
  Cu  Cu34  1  0.443041  0.321551  0.523740  1
  Cu  Cu35  1  0.146340  0.588512  0.502889  1
  Cu  Cu36  1  0.361096  0.832813  0.509898  1
  Cu  Cu37  1  0.413586  0.054466  0.544704  1
  Cu  Cu38  1  0.954633  0.298864  0.551619  1
  Cu  Cu39  1  0.657820  0.565808  0.530801  1
  Cu  Cu40  1  0.872704  0.810047  0.537788  1
  Cu  Cu41  1  0.925145  0.031699  0.572574  1
  Cu  Cu42  1  0.466446  0.276198  0.579496  1
  Cu  Cu43  1  0.169383  0.543052  0.558712  1
  Cu  Cu44  1  0.384232  0.787360  0.565696  1
  Cu  Cu45  1  0.436594  0.009136  0.600501  1
  Cu  Cu46  1  0.978548  0.253658  0.607309  1
  Cu  Cu47  1  0.680960  0.520382  0.586646  1
  Cu  Cu48  1  0.895771  0.764469  0.593597  1
  Cu  Cu49  1  0.948130  0.986029  0.628263  1
  Cu  Cu50  1  0.491352  0.231369  0.635209  1
  Cu  Cu51  1  0.192926  0.497663  0.614609  1
  Cu  Cu52  1  0.406965  0.741990  0.621509  1
  Cu  Cu53  1  0.460291  0.963664  0.656220  1
  Cu  Cu54  1  0.004436  0.207482  0.662589  1
  Cu  Cu55  1  0.704568  0.475221  0.642485  1
  Cu  Cu56  1  0.917923  0.718877  0.649377  1
  Cu  Cu57  1  0.972949  0.940274  0.683612  1
  Cu  Cu58  1  0.517497  0.186247  0.690233  1
  Cu  Cu59  1  0.216197  0.450988  0.670467  1
  Cu  Cu60  1  0.429432  0.695928  0.677079  1
  Cu  Cu61  1  0.485789  0.920518  0.709984  1
  Cu  Cu62  1  0.033473  0.161539  0.715735  1
  Cu  Cu63  1  0.729703  0.429126  0.696918  1
  Cu  Cu64  1  0.936985  0.674754  0.703370  1
