# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.55301359
_cell_length_b   7.96520348
_cell_length_c   49.91344499
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   99.24438509
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu
_chemical_formula_sum   Cu36
_cell_volume   1001.82076867
_cell_formula_units_Z   36
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  0.838442  0.671324  0.307406  1
  Cu  Cu2  1  0.220471  0.435249  0.330945  1
  Cu  Cu3  1  0.600970  0.196243  0.354043  1
  Cu  Cu4  1  0.451104  0.896191  0.334005  1
  Cu  Cu5  1  0.690084  0.373966  0.288878  1
  Cu  Cu6  1  0.070431  0.134887  0.311110  1
  Cu  Cu7  1  0.982044  0.958367  0.377880  1
  Cu  Cu8  1  0.362832  0.719865  0.402011  1
  Cu  Cu9  1  0.743350  0.480847  0.425913  1
  Cu  Cu10  1  0.593229  0.180239  0.405837  1
  Cu  Cu11  1  0.832705  0.659258  0.358161  1
  Cu  Cu12  1  0.212686  0.419195  0.382121  1
  Cu  Cu13  1  0.123960  0.242019  0.449728  1
  Cu  Cu14  1  0.504645  0.003334  0.473632  1
  Cu  Cu15  1  0.885317  0.764619  0.497542  1
  Cu  Cu16  1  0.735422  0.464452  0.477533  1
  Cu  Cu17  1  0.974152  0.942021  0.429727  1
  Cu  Cu18  1  0.354838  0.703336  0.453656  1
  Cu  Cu19  1  0.265965  0.525862  0.521414  1
  Cu  Cu20  1  0.646548  0.286978  0.545292  1
  Cu  Cu21  1  0.027234  0.048292  0.569221  1
  Cu  Cu22  1  0.877426  0.748295  0.549219  1
  Cu  Cu23  1  0.116070  0.225694  0.501406  1
  Cu  Cu24  1  0.496741  0.986979  0.525315  1
  Cu  Cu25  1  0.408158  0.810074  0.593110  1
  Cu  Cu26  1  0.788700  0.571119  0.616826  1
  Cu  Cu27  1  0.168681  0.331055  0.640786  1
  Cu  Cu28  1  0.019342  0.031946  0.621067  1
  Cu  Cu29  1  0.258036  0.509467  0.573034  1
  Cu  Cu30  1  0.638555  0.270448  0.596936  1
  Cu  Cu31  1  0.550283  0.094122  0.664942  1
  Cu  Cu32  1  0.930955  0.855426  0.687838  1
  Cu  Cu33  1  0.311303  0.616348  0.710069  1
  Cu  Cu34  1  0.162944  0.318990  0.691542  1
  Cu  Cu35  1  0.400416  0.794070  0.644905  1
  Cu  Cu36  1  0.780916  0.555064  0.668002  1
