# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.54212788
_cell_length_b   10.65764146
_cell_length_c   46.93977895
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   96.84662073
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu
_chemical_formula_sum   Cu48
_cell_volume   1262.67452734
_cell_formula_units_Z   48
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  0.414444  0.448570  0.298207  1
  Cu  Cu2  1  0.815566  0.250748  0.283362  1
  Cu  Cu3  1  0.698985  0.017575  0.281476  1
  Cu  Cu4  1  0.014304  0.648309  0.312521  1
  Cu  Cu5  1  0.850513  0.320671  0.335547  1
  Cu  Cu6  1  0.252526  0.124655  0.321059  1
  Cu  Cu7  1  0.131559  0.882683  0.316502  1
  Cu  Cu8  1  0.448743  0.517152  0.350237  1
  Cu  Cu9  1  0.284975  0.189570  0.372579  1
  Cu  Cu10  1  0.686303  0.992184  0.356991  1
  Cu  Cu11  1  0.567112  0.753832  0.353967  1
  Cu  Cu12  1  0.883439  0.386522  0.387575  1
  Cu  Cu13  1  0.719890  0.059389  0.409480  1
  Cu  Cu14  1  0.121776  0.863130  0.394099  1
  Cu  Cu15  1  1.002301  0.624216  0.390796  1
  Cu  Cu16  1  0.318238  0.256108  0.424760  1
  Cu  Cu17  1  0.155007  0.929614  0.446528  1
  Cu  Cu18  1  0.556867  0.733311  0.431127  1
  Cu  Cu19  1  0.437529  0.494666  0.427936  1
  Cu  Cu20  1  0.753217  0.126054  0.461851  1
  Cu  Cu21  1  0.590167  0.799925  0.483588  1
  Cu  Cu22  1  0.992035  0.603640  0.468227  1
  Cu  Cu23  1  0.872627  0.364852  0.465044  1
  Cu  Cu24  1  0.188306  0.996224  0.498947  1
  Cu  Cu25  1  0.025327  0.670237  0.520653  1
  Cu  Cu26  1  0.427141  0.473844  0.505312  1
  Cu  Cu27  1  0.307690  0.234968  0.502138  1
  Cu  Cu28  1  0.623434  0.866471  0.536041  1
  Cu  Cu29  1  0.460466  0.540507  0.557697  1
  Cu  Cu30  1  0.862199  0.343953  0.542394  1
  Cu  Cu31  1  0.742767  0.105112  0.539253  1
  Cu  Cu32  1  0.058610  0.736815  0.573130  1
  Cu  Cu33  1  0.895516  0.410599  0.594714  1
  Cu  Cu34  1  0.297236  0.214017  0.579520  1
  Cu  Cu35  1  0.177833  0.975232  0.576392  1
  Cu  Cu36  1  0.493697  0.606985  0.610107  1
  Cu  Cu37  1  0.330858  0.281277  0.631837  1
  Cu  Cu38  1  0.732208  0.083951  0.616640  1
  Cu  Cu39  1  0.612935  0.845424  0.613577  1
  Cu  Cu40  1  0.929105  0.477809  0.646944  1
  Cu  Cu41  1  0.765531  0.150608  0.668428  1
  Cu  Cu42  1  0.166818  0.953153  0.653869  1
  Cu  Cu43  1  0.047603  0.714753  0.650433  1
  Cu  Cu44  1  0.364886  0.349383  0.684200  1
  Cu  Cu45  1  0.200677  0.020860  0.705718  1
  Cu  Cu46  1  0.600993  0.821469  0.691243  1
  Cu  Cu47  1  0.482300  0.584163  0.688119  1
  Cu  Cu48  1  0.799680  0.218930  0.719617  1
