# generated using pymatgen
data_Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.55076313
_cell_length_b   2.55076313
_cell_length_c   58.32221084
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu
_chemical_formula_sum   Cu12
_cell_volume   328.628232749
_cell_formula_units_Z   12
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  0.001507  0.001005  0.374127  1
  Cu  Cu2  1  0.334840  0.667671  0.338492  1
  Cu  Cu3  1  0.001507  0.001005  0.302810  1
  Cu  Cu4  1  0.668174  0.334338  0.409853  1
  Cu  Cu5  1  0.001507  0.001005  0.517026  1
  Cu  Cu6  1  0.334840  0.667671  0.481302  1
  Cu  Cu7  1  0.001507  0.001005  0.445578  1
  Cu  Cu8  1  0.668174  0.334338  0.552750  1
  Cu  Cu9  1  0.001507  0.001005  0.659839  1
  Cu  Cu10  1  0.334840  0.667671  0.624188  1
  Cu  Cu11  1  0.001507  0.001005  0.588475  1
  Cu  Cu12  1  0.668174  0.334338  0.695665  1
