# generated using pymatgen
data_CoAsSe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.56141900
_cell_length_b   4.83412100
_cell_length_c   5.78817987
_cell_angle_alpha   88.73044007
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CoAsSe
_chemical_formula_sum   'Co2 As2 Se2'
_cell_volume   99.62675476
_cell_formula_units_Z   2
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  0.50000000  0.50000000  0.50000000  1.0
  Co  Co1  1  0.00000000  0.00000000  0.00000000  1.0
  As  As2  1  0.50000000  0.29211600  0.12852200  1.0
  As  As3  1  0.50000000  0.70788400  0.87147800  1.0
  Se  Se4  1  0.00000000  0.78418100  0.36287700  1.0
  Se  Se5  1  0.00000000  0.21581900  0.63712300  1.0