# generated using pymatgen
data_In2Se3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.94149654
_cell_length_b   8.94149654
_cell_length_c   8.94149646
_cell_angle_alpha   26.73966540
_cell_angle_beta   26.73966540
_cell_angle_gamma   26.73966419
_symmetry_Int_Tables_number   1
_chemical_formula_structural   In2Se3
_chemical_formula_sum   'In2 Se3'
_cell_volume   127.60575571
_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
  In  In0  1  0.79248700  0.79248700  0.79248700  1.0
  In  In1  1  0.20751300  0.20751300  0.20751300  1.0
  Se  Se2  1  0.60136500  0.60136500  0.60136500  1.0
  Se  Se3  1  0.39863500  0.39863500  0.39863500  1.0
  Se  Se4  1  0.00000000  0.00000000  0.00000000  1.0