# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.54235104
_cell_length_b   2.54235104
_cell_length_c   46.63659427
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   60.00000001
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu
_chemical_formula_sum   Cu10
_cell_volume   261.052883025
_cell_formula_units_Z   10
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  0.333656  0.333979  0.341077  1
  Cu  Cu2  1  0.666990  0.667312  0.296565  1
  Cu  Cu3  1  0.333656  0.333979  0.432307  1
  Cu  Cu4  1  0.666990  0.667312  0.386805  1
  Cu  Cu5  1  0.333656  0.333979  0.523383  1
  Cu  Cu6  1  0.666990  0.667312  0.477849  1
  Cu  Cu7  1  0.333656  0.333979  0.614427  1
  Cu  Cu8  1  0.666990  0.667312  0.568924  1
  Cu  Cu9  1  0.333656  0.333979  0.704667  1
  Cu  Cu10  1  0.666990  0.667312  0.660155  1
