# generated using pymatgen
data_TaPbSe2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.46855130
_cell_length_b   3.46855130
_cell_length_c   9.41303679
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999467
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaPbSe2
_chemical_formula_sum   'Ta1 Pb1 Se2'
_cell_volume   98.07462483
_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
  Ta  Ta0  1  0.00000000  0.00000000  0.50000000  1.0
  Pb  Pb1  1  0.66666700  0.33333300  -0.00000000  1.0
  Se  Se2  1  0.66666700  0.33333300  0.32474416  1.0
  Se  Se3  1  0.66666700  0.33333300  0.67525584  1.0