data_LaTlSb2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.56
_cell_length_b   3.56
_cell_length_c   9.5
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   95.52
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaTlSb2
_chemical_formula_sum   'La1 Tl1 Sb2'
_cell_volume   119.86
_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
  La  La0  1  0.0  0.0  0.31  1.0
  Tl  Tl3  1  0.39  0.0  0.86  1.0
  Sb  Sb1  1  0.39  0.0  0.13  1.0
  Sb  Sb2  1  0.0  0.0  0.96  1.0

data_LaTlSb2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.56
_cell_length_b   3.56
_cell_length_c   9.5
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   95.52
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaTlSb2
_chemical_formula_sum   'La1 Tl1 Sb2'
_cell_volume   119.86
_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
  La  La0  1  0.0  0.0  0.31  1.0
  Tl  Tl1  1  0.39  0.0  0.86  1.0
  Sb  Sb2  1  0.0  0.0  0.96  1.0
  Sb  Sb3  1  0.39  0.0  0.13  1.0

La Tl Sb Sb
La Tl Sb Sb 0 2 o o o 1 3 o o o 1 2 o o + 2 3 o o - 