# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.23980409
_cell_length_b   4.39251839
_cell_length_c   45.81771354
_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   Cu32
_cell_volume   853.282405252
_cell_formula_units_Z   32
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  0.250602  0.644660  0.280435  1
  Cu  Cu2  1  0.750602  0.814536  0.304822  1
  Cu  Cu3  1  0.250602  0.154143  0.305777  1
  Cu  Cu4  1  0.750602  0.322779  0.331563  1
  Cu  Cu5  1  0.250602  0.663321  0.333914  1
  Cu  Cu6  1  0.750602  0.828574  0.360417  1
  Cu  Cu7  1  0.250602  0.164518  0.361039  1
  Cu  Cu8  1  0.750602  0.330686  0.388155  1
  Cu  Cu9  1  0.250602  0.666371  0.389045  1
  Cu  Cu10  1  0.750602  0.832267  0.416327  1
  Cu  Cu11  1  0.250602  0.167582  0.416633  1
  Cu  Cu12  1  0.750602  0.333153  0.444152  1
  Cu  Cu13  1  0.250602  0.668389  0.444511  1
  Cu  Cu14  1  0.750602  0.833818  0.472098  1
  Cu  Cu15  1  0.250602  0.168978  0.472279  1
  Cu  Cu16  1  0.750602  0.334316  0.499924  1
  Cu  Cu17  1  0.250602  0.669475  0.500157  1
  Cu  Cu18  1  0.750602  0.834812  0.527802  1
  Cu  Cu19  1  0.250602  0.169972  0.527983  1
  Cu  Cu20  1  0.750602  0.335402  0.555569  1
  Cu  Cu21  1  0.250602  0.670637  0.555929  1
  Cu  Cu22  1  0.750602  0.836209  0.583447  1
  Cu  Cu23  1  0.250602  0.171523  0.583753  1
  Cu  Cu24  1  0.750602  0.337420  0.611036  1
  Cu  Cu25  1  0.250602  0.673104  0.611926  1
  Cu  Cu26  1  0.750602  0.839273  0.639042  1
  Cu  Cu27  1  0.250602  0.175217  0.639663  1
  Cu  Cu28  1  0.750602  0.340469  0.666167  1
  Cu  Cu29  1  0.250602  0.681012  0.668518  1
  Cu  Cu30  1  0.750602  0.849647  0.694304  1
  Cu  Cu31  1  0.250602  0.189254  0.695259  1
  Cu  Cu32  1  0.750602  0.359130  0.719646  1
