# generated using pymatgen
data_CuTeSe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.40034300
_cell_length_b   6.40034300
_cell_length_c   6.40034300
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CuTeSe
_chemical_formula_sum   'Cu4 Te4 Se4'
_cell_volume   262.18615010
_cell_formula_units_Z   4
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  0.51016000  0.48984000  0.98984000  1.0
  Cu  Cu1  1  0.48984000  0.98984000  0.51016000  1.0
  Cu  Cu2  1  0.98984000  0.51016000  0.48984000  1.0
  Cu  Cu3  1  0.01016000  0.01016000  0.01016000  1.0
  Te  Te4  1  0.87990100  0.12009900  0.62009900  1.0
  Te  Te5  1  0.12009900  0.62009900  0.87990100  1.0
  Te  Te6  1  0.62009900  0.87990100  0.12009900  1.0
  Te  Te7  1  0.37990100  0.37990100  0.37990100  1.0
  Se  Se8  1  0.11642900  0.88357100  0.38357100  1.0
  Se  Se9  1  0.88357100  0.38357100  0.11642900  1.0
  Se  Se10  1  0.38357100  0.11642900  0.88357100  1.0
  Se  Se11  1  0.61642900  0.61642900  0.61642900  1.0