# generated using pymatgen
data_Th2Se2O
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.86054500
_cell_length_b   3.86054500
_cell_length_c   11.87392200
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Th2Se2O
_chemical_formula_sum   'Th2 Se2 O1'
_cell_volume   176.96665010
_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
  Th  Th0  1  0.50000000  0.50000000  0.17859100  1.0
  Th  Th1  1  0.50000000  0.50000000  0.82140900  1.0
  Se  Se2  1  0.50000000  0.50000000  0.59749700  1.0
  Se  Se3  1  0.50000000  0.50000000  0.40250300  1.0
  O  O4  1  0.50000000  0.50000000  0.00000000  1.0