data_TlCdPt
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.41
_cell_length_b   5.41
_cell_length_c   5.41
_cell_angle_alpha   142.58
_cell_angle_beta   139.61
_cell_angle_gamma   56.23
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TlCdPt
_chemical_formula_sum   'Tl1 Cd1 Pt1'
_cell_volume   61.73
_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  Tl2  1  0.0  0.0  0.11  1.0
  Cd  Cd0  1  0.0  0.0  0.16  1.0
  Pt  Pt1  1  0.0  0.0  0.27  1.0

data_TlCdPt
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.47
_cell_length_b   3.73
_cell_length_c   5.41
_cell_angle_alpha   110.19
_cell_angle_beta   108.71
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TlCdPt
_chemical_formula_sum   'Tl1 Cd1 Pt1'
_cell_volume   61.73
_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  0.89  0.89  0.89  1.0
  Cd  Cd1  1  0.84  0.84  0.84  1.0
  Pt  Pt2  1  0.73  0.73  0.73  1.0

Tl Cd Pt