# generated using pymatgen
data_CoAsSe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.77229648
_cell_length_b   5.77229648
_cell_length_c   5.77229648
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CoAsSe
_chemical_formula_sum   'Co4 As4 Se4'
_cell_volume   192.32949374
_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
  Co  Co0  1  0.50175400  0.49824600  0.99824600  1
  Co  Co1  1  0.49824600  0.99824600  0.50175400  1
  Co  Co2  1  0.99824600  0.50175400  0.49824600  1
  Co  Co3  1  0.00175400  0.00175400  0.00175400  1
  As  As4  1  0.12395400  0.87604600  0.37604600  1
  As  As5  1  0.87604600  0.37604600  0.12395400  1
  As  As6  1  0.37604600  0.12395400  0.87604600  1
  As  As7  1  0.62395400  0.62395400  0.62395400  1
  Se  Se8  1  0.87687100  0.12312900  0.62312900  1
  Se  Se9  1  0.12312900  0.62312900  0.87687100  1
  Se  Se10  1  0.62312900  0.87687100  0.12312900  1
  Se  Se11  1  0.37687100  0.37687100  0.37687100  1
