# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.60646519
_cell_length_b   11.42757767
_cell_length_c   48.67792230
_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   Cu72
_cell_volume   2006.1710498
_cell_formula_units_Z   72
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  1.004522  0.251344  0.301007  1
  Cu  Cu2  1  1.004522  0.850777  0.347296  1
  Cu  Cu3  1  1.004522  0.548821  0.323296  1
  Cu  Cu4  1  0.504522  0.103088  0.290230  1
  Cu  Cu5  1  0.504522  0.701010  0.335707  1
  Cu  Cu6  1  0.504522  0.399104  0.311626  1
  Cu  Cu7  1  0.504522  0.201010  0.335707  1
  Cu  Cu8  1  0.504522  0.899104  0.311626  1
  Cu  Cu9  1  0.504522  0.603088  0.290230  1
  Cu  Cu10  1  1.004522  0.048821  0.323296  1
  Cu  Cu11  1  1.004522  0.751344  0.301007  1
  Cu  Cu12  1  1.004522  0.350777  0.347296  1
  Cu  Cu13  1  1.004522  0.149610  0.370810  1
  Cu  Cu14  1  1.004522  0.748132  0.418698  1
  Cu  Cu15  1  1.004522  0.449281  0.394787  1
  Cu  Cu16  1  0.504522  1.000014  0.358621  1
  Cu  Cu17  1  0.504522  0.598497  0.406643  1
  Cu  Cu18  1  0.504522  0.299811  0.382963  1
  Cu  Cu19  1  0.504522  0.098497  0.406643  1
  Cu  Cu20  1  0.504522  0.799811  0.382963  1
  Cu  Cu21  1  0.504522  0.500014  0.358621  1
  Cu  Cu22  1  1.004522  0.949281  0.394787  1
  Cu  Cu23  1  1.004522  0.649610  0.370810  1
  Cu  Cu24  1  1.004522  0.248132  0.418698  1
  Cu  Cu25  1  1.004522  0.047281  0.442617  1
  Cu  Cu26  1  1.004522  0.645422  0.490475  1
  Cu  Cu27  1  1.004522  0.346306  0.466557  1
  Cu  Cu28  1  0.504522  0.897781  0.430720  1
  Cu  Cu29  1  0.504522  0.495896  0.478522  1
  Cu  Cu30  1  0.504522  0.196739  0.454562  1
  Cu  Cu31  1  0.504522  0.995896  0.478522  1
  Cu  Cu32  1  0.504522  0.696739  0.454562  1
  Cu  Cu33  1  0.504522  0.397781  0.430720  1
  Cu  Cu34  1  1.004522  0.846306  0.466557  1
  Cu  Cu35  1  1.004522  0.547281  0.442617  1
  Cu  Cu36  1  1.004522  0.145422  0.490475  1
  Cu  Cu37  1  1.004522  0.944457  0.514387  1
  Cu  Cu38  1  1.004522  0.542572  0.562189  1
  Cu  Cu39  1  1.004522  0.243615  0.538347  1
  Cu  Cu40  1  0.504522  0.794932  0.502434  1
  Cu  Cu41  1  0.504522  0.393072  0.550292  1
  Cu  Cu42  1  0.504522  0.094047  0.526352  1
  Cu  Cu43  1  0.504522  0.893072  0.550292  1
  Cu  Cu44  1  0.504522  0.594047  0.526352  1
  Cu  Cu45  1  0.504522  0.294932  0.502434  1
  Cu  Cu46  1  1.004522  0.743615  0.538347  1
  Cu  Cu47  1  1.004522  0.444457  0.514387  1
  Cu  Cu48  1  1.004522  0.042572  0.562189  1
  Cu  Cu49  1  1.004522  0.841856  0.586266  1
  Cu  Cu50  1  1.004522  0.440340  0.634288  1
  Cu  Cu51  1  1.004522  0.140542  0.609946  1
  Cu  Cu52  1  0.504522  0.692221  0.574211  1
  Cu  Cu53  1  0.504522  0.290743  0.622099  1
  Cu  Cu54  1  0.504522  0.991072  0.598122  1
  Cu  Cu55  1  0.504522  0.790743  0.622099  1
  Cu  Cu56  1  0.504522  0.491072  0.598122  1
  Cu  Cu57  1  0.504522  0.192221  0.574211  1
  Cu  Cu58  1  1.004522  0.640542  0.609946  1
  Cu  Cu59  1  1.004522  0.341856  0.586266  1
  Cu  Cu60  1  1.004522  0.940340  0.634288  1
  Cu  Cu61  1  1.004522  0.739343  0.657202  1
  Cu  Cu62  1  1.004522  0.337265  0.702679  1
  Cu  Cu63  1  1.004522  0.041249  0.681283  1
  Cu  Cu64  1  0.504522  0.589576  0.645613  1
  Cu  Cu65  1  0.504522  0.189009  0.691902  1
  Cu  Cu66  1  0.504522  0.891532  0.669613  1
  Cu  Cu67  1  0.504522  0.689009  0.691902  1
  Cu  Cu68  1  0.504522  0.391532  0.669613  1
  Cu  Cu69  1  0.504522  0.089576  0.645613  1
  Cu  Cu70  1  1.004522  0.541249  0.681283  1
  Cu  Cu71  1  1.004522  0.239343  0.657202  1
  Cu  Cu72  1  1.004522  0.837265  0.702679  1
