# generated using pymatgen
data_TlSbSe2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.00479400
_cell_length_b   4.35351400
_cell_length_c   4.36073840
_cell_angle_alpha   88.05769567
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TlSbSe2
_chemical_formula_sum   'Tl1 Sb1 Se2'
_cell_volume   113.93272986
_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
  Tl  Tl0  1  0.00000000  0.01022000  0.02273500  1.0
  Sb  Sb1  1  0.50000000  0.98015700  0.95113600  1.0
  Se  Se2  1  0.00000000  0.48858600  0.48551400  1.0
  Se  Se3  1  0.50000000  0.52103600  0.54061400  1.0