# generated using pymatgen
data_ThSiSe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.31030068
_cell_length_b   9.31030068
_cell_length_c   9.31030068
_cell_angle_alpha   155.17136079
_cell_angle_beta   155.17136079
_cell_angle_gamma   35.39924735
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ThSiSe
_chemical_formula_sum   'Th2 Si2 Se2'
_cell_volume   142.12954976
_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
  Th  Th0  1  0.86983287  0.86983287  -0.00000000  1.0
  Th  Th1  1  0.13016713  0.13016713  0.00000000  1.0
  Si  Si2  1  -0.00000000  0.50000000  0.50000000  1.0
  Si  Si3  1  0.50000000  -0.00000000  0.50000000  1.0
  Se  Se4  1  0.68866014  0.68866014  0.00000000  1.0
  Se  Se5  1  0.31133986  0.31133986  -0.00000000  1.0