data_YTiTl2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.59
_cell_length_b   5.13
_cell_length_c   5.26
_cell_angle_alpha   90.0
_cell_angle_beta   90.56
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YTiTl2
_chemical_formula_sum   'Y1 Ti1 Tl2'
_cell_volume   96.99
_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
  Y  Y3  1  0.36  0.57  0.23  1.0
  Ti  Ti0  1  0.25  0.0  0.38  1.0
  Tl  Tl1  1  0.11  0.57  0.81  1.0
  Tl  Tl2  1  0.13  0.0  0.74  1.0

data_YTiTl2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.59
_cell_length_b   5.13
_cell_length_c   5.26
_cell_angle_alpha   90.0
_cell_angle_beta   90.56
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YTiTl2
_chemical_formula_sum   'Y1 Ti1 Tl2'
_cell_volume   96.99
_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
  Y  Y0  1  0.36  0.57  0.23  1.0
  Ti  Ti1  1  0.25  0.0  0.38  1.0
  Tl  Tl2  1  0.11  0.57  0.81  1.0
  Tl  Tl3  1  0.13  0.0  0.74  1.0

Y Ti Tl Tl