data_TlZnPt2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.28
_cell_length_b   5.28
_cell_length_c   5.28
_cell_angle_alpha   136.41
_cell_angle_beta   136.41
_cell_angle_gamma   63.35
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TlZnPt2
_chemical_formula_sum   'Tl1 Zn1 Pt2'
_cell_volume   69.18
_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  0.96  0.25  1.0
  Zn  Zn3  1  0.0  0.0  0.0  1.0
  Pt  Pt0  1  0.96  0.0  0.25  1.0
  Pt  Pt1  1  0.0  0.0  0.5  1.0

data_TlZnPt2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.92
_cell_length_b   3.92
_cell_length_c   5.28
_cell_angle_alpha   111.8
_cell_angle_beta   111.8
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TlZnPt2
_chemical_formula_sum   'Tl1 Zn1 Pt2'
_cell_volume   69.18
_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  0.29  0.25  0.29  1.0
  Zn  Zn1  1  0.0  0.0  0.0  1.0
  Pt  Pt2  1  0.25  0.29  0.29  1.0
  Pt  Pt3  1  0.5  0.5  0.5  1.0

Tl Zn Pt Pt