# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.53590032
_cell_length_b   9.43916076
_cell_length_c   47.28188968
_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   Cu44
_cell_volume   1131.77575629
_cell_formula_units_Z   44
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  0.127678  0.766294  0.278723  1
  Cu  Cu2  1  0.627678  0.941098  0.309735  1
  Cu  Cu3  1  0.627678  0.266345  0.280149  1
  Cu  Cu4  1  0.127678  0.503019  0.284735  1
  Cu  Cu5  1  0.627678  0.666637  0.319635  1
  Cu  Cu6  1  0.127678  0.833536  0.352324  1
  Cu  Cu7  1  0.127678  0.167106  0.320743  1
  Cu  Cu8  1  0.627678  0.401522  0.326648  1
  Cu  Cu9  1  0.127678  0.563790  0.361157  1
  Cu  Cu10  1  0.627678  0.727630  0.395005  1
  Cu  Cu11  1  0.627678  0.061310  0.361614  1
  Cu  Cu12  1  0.127678  0.295786  0.368228  1
  Cu  Cu13  1  0.627678  0.458562  0.402808  1
  Cu  Cu14  1  0.127678  0.621123  0.437194  1
  Cu  Cu15  1  0.127678  0.957197  0.403080  1
  Cu  Cu16  1  0.627678  0.190525  0.409860  1
  Cu  Cu17  1  0.127678  0.352833  0.444536  1
  Cu  Cu18  1  0.627678  0.514879  0.479150  1
  Cu  Cu19  1  0.627678  0.852023  0.444750  1
  Cu  Cu20  1  0.127678  0.084976  0.451534  1
  Cu  Cu21  1  0.627678  0.246873  0.486299  1
  Cu  Cu22  1  0.127678  0.408895  0.520952  1
  Cu  Cu23  1  0.127678  0.746284  0.486491  1
  Cu  Cu24  1  0.627678  0.979191  0.493250  1
  Cu  Cu25  1  0.127678  0.140776  0.528085  1
  Cu  Cu26  1  0.627678  0.303199  0.562607  1
  Cu  Cu27  1  0.627678  0.640324  0.528320  1
  Cu  Cu28  1  0.127678  0.873261  0.534993  1
  Cu  Cu29  1  0.627678  0.034585  0.569907  1
  Cu  Cu30  1  0.127678  0.198031  0.604088  1
  Cu  Cu31  1  0.127678  0.534156  0.570226  1
  Cu  Cu32  1  0.627678  0.767421  0.576785  1
  Cu  Cu33  1  0.127678  0.928455  0.611852  1
  Cu  Cu34  1  0.627678  0.094544  0.645318  1
  Cu  Cu35  1  0.627678  0.427629  0.612270  1
  Cu  Cu36  1  0.127678  0.661194  0.618528  1
  Cu  Cu37  1  0.627678  0.820728  0.653741  1
  Cu  Cu38  1  0.127678  0.988608  0.685490  1
  Cu  Cu39  1  0.127678  0.321755  0.654548  1
  Cu  Cu40  1  0.627678  0.555161  0.660178  1
  Cu  Cu41  1  0.127678  0.714437  0.695875  1
  Cu  Cu42  1  0.627678  0.891222  0.725490  1
  Cu  Cu43  1  0.627678  0.213918  0.696819  1
  Cu  Cu44  1  0.127678  0.450302  0.701690  1
