# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.54004611
_cell_length_b   5.11242895
_cell_length_c   46.50178231
_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   841.600147362
_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  0.510586  0.124994  0.313969  1
  Cu  Cu2  1  1.010586  0.874994  0.287028  1
  Cu  Cu3  1  1.010586  0.374994  0.287028  1
  Cu  Cu4  1  0.510586  0.624994  0.313969  1
  Cu  Cu5  1  0.510586  0.624994  0.369354  1
  Cu  Cu6  1  1.010586  0.374994  0.341865  1
  Cu  Cu7  1  1.010586  0.874994  0.341865  1
  Cu  Cu8  1  0.510586  0.124994  0.369354  1
  Cu  Cu9  1  0.510586  0.124994  0.425095  1
  Cu  Cu10  1  1.010586  0.874994  0.397302  1
  Cu  Cu11  1  1.010586  0.374994  0.397302  1
  Cu  Cu12  1  0.510586  0.624994  0.425095  1
  Cu  Cu13  1  0.510586  0.624994  0.480799  1
  Cu  Cu14  1  1.010586  0.374994  0.452968  1
  Cu  Cu15  1  1.010586  0.874994  0.452968  1
  Cu  Cu16  1  0.510586  0.124994  0.480799  1
  Cu  Cu17  1  0.510586  0.124994  0.536486  1
  Cu  Cu18  1  1.010586  0.874994  0.508655  1
  Cu  Cu19  1  1.010586  0.374994  0.508655  1
  Cu  Cu20  1  0.510586  0.624994  0.536486  1
  Cu  Cu21  1  0.510586  0.624994  0.592152  1
  Cu  Cu22  1  1.010586  0.374994  0.564358  1
  Cu  Cu23  1  1.010586  0.874994  0.564358  1
  Cu  Cu24  1  0.510586  0.124994  0.592152  1
  Cu  Cu25  1  0.510586  0.124994  0.647588  1
  Cu  Cu26  1  1.010586  0.874994  0.620100  1
  Cu  Cu27  1  1.010586  0.374994  0.620100  1
  Cu  Cu28  1  0.510586  0.624994  0.647588  1
  Cu  Cu29  1  0.510586  0.624994  0.702426  1
  Cu  Cu30  1  1.010586  0.374994  0.675485  1
  Cu  Cu31  1  1.010586  0.874994  0.675485  1
  Cu  Cu32  1  0.510586  0.124994  0.702426  1
