# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.07333903
_cell_length_b   6.37312019
_cell_length_c   47.96946577
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   108.43494882
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu
_chemical_formula_sum   Cu44
_cell_volume   1181.37779534
_cell_formula_units_Z   44
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  0.694236  0.457168  0.294190  1
  Cu  Cu2  1  0.906360  0.885905  0.314255  1
  Cu  Cu3  1  0.080711  0.228275  0.286015  1
  Cu  Cu4  1  0.300138  0.671134  0.303624  1
  Cu  Cu5  1  0.128353  0.335539  0.334537  1
  Cu  Cu6  1  0.347399  0.779259  0.353512  1
  Cu  Cu7  1  0.518673  0.112636  0.322025  1
  Cu  Cu8  1  0.736717  0.555173  0.344263  1
  Cu  Cu9  1  0.564052  0.218222  0.373171  1
  Cu  Cu10  1  0.783785  0.664016  0.394078  1
  Cu  Cu11  1  0.955115  0.997762  0.363909  1
  Cu  Cu12  1  0.174737  0.442840  0.384133  1
  Cu  Cu13  1  0.001910  0.106191  0.413893  1
  Cu  Cu14  1  0.220844  0.549995  0.434045  1
  Cu  Cu15  1  0.392961  0.885267  0.403759  1
  Cu  Cu16  1  0.611187  0.327584  0.423605  1
  Cu  Cu17  1  0.439397  0.993094  0.453852  1
  Cu  Cu18  1  0.657820  0.435900  0.473882  1
  Cu  Cu19  1  0.830115  0.771577  0.444045  1
  Cu  Cu20  1  0.048423  0.214169  0.463935  1
  Cu  Cu21  1  0.876468  0.879239  0.494074  1
  Cu  Cu22  1  0.094926  0.322142  0.513962  1
  Cu  Cu23  1  0.267305  0.657885  0.484030  1
  Cu  Cu24  1  0.485763  0.100788  0.503918  1
  Cu  Cu25  1  0.313808  0.765858  0.534057  1
  Cu  Cu26  1  0.532116  0.208449  0.553947  1
  Cu  Cu27  1  0.704411  0.544126  0.524110  1
  Cu  Cu28  1  0.922834  0.986933  0.544140  1
  Cu  Cu29  1  0.751044  0.652442  0.574387  1
  Cu  Cu30  1  0.969270  0.094760  0.594234  1
  Cu  Cu31  1  0.141387  0.430032  0.563947  1
  Cu  Cu32  1  0.360321  0.873835  0.584099  1
  Cu  Cu33  1  0.187494  0.537187  0.613860  1
  Cu  Cu34  1  0.407116  0.982265  0.634083  1
  Cu  Cu35  1  0.578446  0.316011  0.603914  1
  Cu  Cu36  1  0.798179  0.761805  0.624822  1
  Cu  Cu37  1  0.625514  0.424853  0.653729  1
  Cu  Cu38  1  0.843558  0.867390  0.675968  1
  Cu  Cu39  1  0.014832  0.200768  0.644480  1
  Cu  Cu40  1  0.233878  0.644487  0.663455  1
  Cu  Cu41  1  0.062092  0.308893  0.694369  1
  Cu  Cu42  1  0.281520  0.751751  0.711977  1
  Cu  Cu43  1  0.455871  0.094121  0.683737  1
  Cu  Cu44  1  0.667995  0.522859  0.703802  1
