# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.15900589
_cell_length_b   4.40739665
_cell_length_c   46.11454289
_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   845.297493057
_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  0.751601  0.645254  0.279140  1
  Cu  Cu2  1  0.251601  0.821746  0.303805  1
  Cu  Cu3  1  0.751601  0.156596  0.304302  1
  Cu  Cu4  1  0.251601  0.325808  0.330976  1
  Cu  Cu5  1  0.751601  0.663172  0.332863  1
  Cu  Cu6  1  0.251601  0.829562  0.359540  1
  Cu  Cu7  1  0.751601  0.165763  0.359830  1
  Cu  Cu8  1  0.251601  0.331177  0.387181  1
  Cu  Cu9  1  0.751601  0.667369  0.387926  1
  Cu  Cu10  1  0.251601  0.832489  0.415301  1
  Cu  Cu11  1  0.751601  0.168588  0.415456  1
  Cu  Cu12  1  0.251601  0.333188  0.443065  1
  Cu  Cu13  1  0.751601  0.669319  0.443378  1
  Cu  Cu14  1  0.251601  0.833775  0.471008  1
  Cu  Cu15  1  0.751601  0.169901  0.471103  1
  Cu  Cu16  1  0.251601  0.334217  0.498789  1
  Cu  Cu17  1  0.751601  0.670354  0.498996  1
  Cu  Cu18  1  0.251601  0.834670  0.526682  1
  Cu  Cu19  1  0.751601  0.170796  0.526777  1
  Cu  Cu20  1  0.251601  0.335252  0.554407  1
  Cu  Cu21  1  0.751601  0.671383  0.554720  1
  Cu  Cu22  1  0.251601  0.835983  0.582329  1
  Cu  Cu23  1  0.751601  0.172082  0.582483  1
  Cu  Cu24  1  0.251601  0.337202  0.609859  1
  Cu  Cu25  1  0.751601  0.673394  0.610603  1
  Cu  Cu26  1  0.251601  0.838808  0.637955  1
  Cu  Cu27  1  0.751601  0.175009  0.638244  1
  Cu  Cu28  1  0.251601  0.341399  0.664921  1
  Cu  Cu29  1  0.751601  0.678764  0.666808  1
  Cu  Cu30  1  0.251601  0.847976  0.693483  1
  Cu  Cu31  1  0.751601  0.182825  0.693980  1
  Cu  Cu32  1  0.251601  0.359318  0.718645  1
