# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.43937881
_cell_length_b   4.92917527
_cell_length_c   49.71547715
_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   Cu36
_cell_volume   842.841447225
_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  0.507668  0.375957  0.285521  1
  Cu  Cu2  1  1.007668  0.625957  0.308832  1
  Cu  Cu3  1  1.007668  0.125957  0.308832  1
  Cu  Cu4  1  0.507668  0.875957  0.285521  1
  Cu  Cu5  1  0.507668  0.875957  0.333832  1
  Cu  Cu6  1  1.007668  0.125957  0.358665  1
  Cu  Cu7  1  1.007668  0.625957  0.358665  1
  Cu  Cu8  1  0.507668  0.375957  0.333832  1
  Cu  Cu9  1  0.507668  0.375957  0.383818  1
  Cu  Cu10  1  1.007668  0.625957  0.408884  1
  Cu  Cu11  1  1.007668  0.125957  0.408884  1
  Cu  Cu12  1  0.507668  0.875957  0.383818  1
  Cu  Cu13  1  0.507668  0.875957  0.433978  1
  Cu  Cu14  1  1.007668  0.125957  0.459060  1
  Cu  Cu15  1  1.007668  0.625957  0.459060  1
  Cu  Cu16  1  0.507668  0.375957  0.433978  1
  Cu  Cu17  1  0.507668  0.375957  0.484146  1
  Cu  Cu18  1  1.007668  0.625957  0.509230  1
  Cu  Cu19  1  1.007668  0.125957  0.509230  1
  Cu  Cu20  1  0.507668  0.875957  0.484146  1
  Cu  Cu21  1  0.507668  0.875957  0.534316  1
  Cu  Cu22  1  1.007668  0.125957  0.559398  1
  Cu  Cu23  1  1.007668  0.625957  0.559398  1
  Cu  Cu24  1  0.507668  0.375957  0.534316  1
  Cu  Cu25  1  0.507668  0.375957  0.584491  1
  Cu  Cu26  1  1.007668  0.625957  0.609557  1
  Cu  Cu27  1  1.007668  0.125957  0.609557  1
  Cu  Cu28  1  0.507668  0.875957  0.584491  1
  Cu  Cu29  1  0.507668  0.875957  0.634711  1
  Cu  Cu30  1  1.007668  0.125957  0.659544  1
  Cu  Cu31  1  1.007668  0.625957  0.659544  1
  Cu  Cu32  1  0.507668  0.375957  0.634711  1
  Cu  Cu33  1  0.507668  0.375957  0.684544  1
  Cu  Cu34  1  1.007668  0.625957  0.707854  1
  Cu  Cu35  1  1.007668  0.125957  0.707854  1
  Cu  Cu36  1  0.507668  0.875957  0.684544  1
