# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.20063119
_cell_length_b   6.75674147
_cell_length_c   45.43761095
_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   1289.63658066
_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  0.251255  0.147951  0.320401  1
  Cu  Cu2  1  0.251255  0.863530  0.285599  1
  Cu  Cu3  1  0.251255  0.504671  0.302698  1
  Cu  Cu4  1  0.751255  0.071811  0.291020  1
  Cu  Cu5  1  0.751255  0.716994  0.308222  1
  Cu  Cu6  1  0.751255  0.362407  0.326302  1
  Cu  Cu7  1  0.251255  0.074262  0.375728  1
  Cu  Cu8  1  0.251255  0.789637  0.338769  1
  Cu  Cu9  1  0.251255  0.431572  0.357133  1
  Cu  Cu10  1  0.751255  0.003735  0.344735  1
  Cu  Cu11  1  0.751255  0.646431  0.363278  1
  Cu  Cu12  1  0.751255  0.289894  0.381892  1
  Cu  Cu13  1  0.251255  1.002014  0.431407  1
  Cu  Cu14  1  0.251255  0.716548  0.394248  1
  Cu  Cu15  1  0.251255  0.359332  0.412805  1
  Cu  Cu16  1  0.751255  0.932685  0.400521  1
  Cu  Cu17  1  0.751255  0.575575  0.419146  1
  Cu  Cu18  1  0.751255  0.218394  0.437739  1
  Cu  Cu19  1  0.251255  0.930475  0.487175  1
  Cu  Cu20  1  0.251255  0.644809  0.449988  1
  Cu  Cu21  1  0.251255  0.287650  0.468574  1
  Cu  Cu22  1  0.751255  0.861215  0.456355  1
  Cu  Cu23  1  0.751255  0.504034  0.474960  1
  Cu  Cu24  1  0.751255  0.146886  0.493553  1
  Cu  Cu25  1  0.251255  0.858983  0.542974  1
  Cu  Cu26  1  0.251255  0.573312  0.505775  1
  Cu  Cu27  1  0.251255  0.216164  0.524368  1
  Cu  Cu28  1  0.751255  0.789723  0.512153  1
  Cu  Cu29  1  0.751255  0.432548  0.530754  1
  Cu  Cu30  1  0.751255  0.075389  0.549340  1
  Cu  Cu31  1  0.251255  0.787513  0.598807  1
  Cu  Cu32  1  0.251255  0.501803  0.561590  1
  Cu  Cu33  1  0.251255  0.144623  0.580183  1
  Cu  Cu34  1  0.751255  0.718184  0.567921  1
  Cu  Cu35  1  0.751255  0.360866  0.586523  1
  Cu  Cu36  1  0.751255  0.003649  0.605080  1
  Cu  Cu37  1  0.251255  0.716463  0.654593  1
  Cu  Cu38  1  0.251255  0.430304  0.617437  1
  Cu  Cu39  1  0.251255  0.073767  0.636050  1
  Cu  Cu40  1  0.751255  0.645936  0.623600  1
  Cu  Cu41  1  0.751255  0.288626  0.642195  1
  Cu  Cu42  1  0.751255  0.930561  0.660559  1
  Cu  Cu43  1  0.251255  0.648387  0.708309  1
  Cu  Cu44  1  0.251255  0.357791  0.673026  1
  Cu  Cu45  1  0.251255  0.003204  0.691107  1
  Cu  Cu46  1  0.751255  0.572247  0.678927  1
  Cu  Cu47  1  0.751255  0.215527  0.696631  1
  Cu  Cu48  1  0.751255  0.856668  0.713730  1
