# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.52451061
_cell_length_b   9.52495416
_cell_length_c   50.29065316
_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   Cu48
_cell_volume   1209.28139265
_cell_formula_units_Z   48
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  0.580680  0.012439  0.251579  1
  Cu  Cu2  1  0.580680  0.617080  0.290280  1
  Cu  Cu3  1  0.580680  0.277136  0.256855  1
  Cu  Cu4  1  1.080680  0.117080  0.290280  1
  Cu  Cu5  1  1.080680  0.777136  0.256855  1
  Cu  Cu6  1  1.080680  0.512439  0.251579  1
  Cu  Cu7  1  0.580680  0.882926  0.295999  1
  Cu  Cu8  1  0.580680  0.487741  0.335381  1
  Cu  Cu9  1  0.580680  0.221714  0.329291  1
  Cu  Cu10  1  1.080680  -0.012259  0.335381  1
  Cu  Cu11  1  1.080680  0.721714  0.329291  1
  Cu  Cu12  1  1.080680  0.382926  0.295999  1
  Cu  Cu13  1  0.580680  0.825905  0.368615  1
  Cu  Cu14  1  0.580680  0.430244  0.407951  1
  Cu  Cu15  1  0.580680  0.092335  0.374782  1
  Cu  Cu16  1  1.080680  0.930244  0.407951  1
  Cu  Cu17  1  1.080680  0.592335  0.374782  1
  Cu  Cu18  1  0.080680  0.325905  0.368615  1
  Cu  Cu19  1  0.580680  0.696755  0.414176  1
  Cu  Cu20  1  0.580680  0.301133  0.453548  1
  Cu  Cu21  1  0.580680  0.034563  0.447305  1
  Cu  Cu22  1  1.080680  0.801133  0.453548  1
  Cu  Cu23  1  1.080680  0.534563  0.447305  1
  Cu  Cu24  1  1.080680  0.196755  0.414176  1
  Cu  Cu25  1  0.580680  0.638911  0.486666  1
  Cu  Cu26  1  0.580680  0.243288  0.526038  1
  Cu  Cu27  1  0.580680  0.905481  0.492909  1
  Cu  Cu28  1  1.080680  0.743288  0.526038  1
  Cu  Cu29  1  1.080680  0.405481  0.492909  1
  Cu  Cu30  1  1.080680  0.138911  0.486666  1
  Cu  Cu31  1  0.580680  0.509800  0.532263  1
  Cu  Cu32  1  0.580680  0.114138  0.571599  1
  Cu  Cu33  1  0.580680  0.847708  0.565432  1
  Cu  Cu34  1  1.080680  0.614138  0.571599  1
  Cu  Cu35  1  1.080680  0.347708  0.565432  1
  Cu  Cu36  1  1.080680  0.009800  0.532263  1
  Cu  Cu37  1  0.580680  0.452303  0.604833  1
  Cu  Cu38  1  0.580680  0.057117  0.644215  1
  Cu  Cu39  1  0.580680  0.718330  0.610924  1
  Cu  Cu40  1  1.080680  0.557117  0.644215  1
  Cu  Cu41  1  1.080680  0.218330  0.610924  1
  Cu  Cu42  1  1.080680  0.952303  0.604833  1
  Cu  Cu43  1  0.580680  0.322963  0.649934  1
  Cu  Cu44  1  0.580680  0.927604  0.688635  1
  Cu  Cu45  1  0.580680  0.662907  0.683359  1
  Cu  Cu46  1  1.080680  0.427604  0.688635  1
  Cu  Cu47  1  1.080680  0.162907  0.683359  1
  Cu  Cu48  1  0.080680  0.822963  0.649934  1
