# generated using pymatgen
data_Cu13Se8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.09644194
_cell_length_b   8.09644194
_cell_length_c   8.09644194
_cell_angle_alpha   60.00000000
_cell_angle_beta   60.00000000
_cell_angle_gamma   60.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu13Se8
_chemical_formula_sum   'Cu13 Se8'
_cell_volume   375.29054237
_cell_formula_units_Z   1
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  Cu0  1  0.74682500  0.25317500  0.25317500  1.0
  Cu  Cu1  1  0.25317500  0.25317500  0.74682500  1.0
  Cu  Cu2  1  0.25317500  0.74682500  0.25317500  1.0
  Cu  Cu3  1  0.74682500  0.25317500  0.74682500  1.0
  Cu  Cu4  1  0.74682500  0.74682500  0.25317500  1.0
  Cu  Cu5  1  0.25317500  0.74682500  0.74682500  1.0
  Cu  Cu6  1  0.99579300  0.50420700  0.50420700  1.0
  Cu  Cu7  1  0.50420700  0.50420700  0.99579300  1.0
  Cu  Cu8  1  0.50420700  0.99579300  0.50420700  1.0
  Cu  Cu9  1  0.99579300  0.50420700  0.99579300  1.0
  Cu  Cu10  1  0.50420700  0.99579300  0.99579300  1.0
  Cu  Cu11  1  0.99579300  0.99579300  0.50420700  1.0
  Cu  Cu12  1  0.00000000  0.00000000  0.00000000  1.0
  Se  Se13  1  0.12725200  0.12725200  0.12725200  1.0
  Se  Se14  1  0.61824400  0.12725200  0.12725200  1.0
  Se  Se15  1  0.12725200  0.12725200  0.61824400  1.0
  Se  Se16  1  0.12725200  0.61824400  0.12725200  1.0
  Se  Se17  1  0.62492300  0.12523000  0.62492300  1.0
  Se  Se18  1  0.62492300  0.62492300  0.12523000  1.0
  Se  Se19  1  0.12523000  0.62492300  0.62492300  1.0
  Se  Se20  1  0.62492300  0.62492300  0.62492300  1.0