data_AlTl2Pd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.0
_cell_length_b   5.0
_cell_length_c   5.6
_cell_angle_alpha   103.89
_cell_angle_beta   103.89
_cell_angle_gamma   40.79
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlTl2Pd
_chemical_formula_sum   'Al1 Tl2 Pd1'
_cell_volume   88.34
_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
  Al  Al0  1  0.0  0.0  0.0  1.0
  Tl  Tl2  1  0.72  0.0  0.41  1.0
  Tl  Tl3  1  0.21  0.0  0.01  1.0
  Pd  Pd1  1  0.97  0.0  0.71  1.0

data_AlTl2Pd
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.48
_cell_length_b   5.0
_cell_length_c   5.6
_cell_angle_alpha   103.89
_cell_angle_beta   90.0
_cell_angle_gamma   110.4
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlTl2Pd
_chemical_formula_sum   'Al1 Tl2 Pd1'
_cell_volume   88.34
_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
  Al  Al0  1  0.0  0.0  0.0  1.0
  Tl  Tl1  1  0.0  0.28  0.59  1.0
  Tl  Tl2  1  0.0  0.79  0.99  1.0
  Pd  Pd3  1  0.0  0.03  0.29  1.0

Al Tl Tl Pd