data_TlZn2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.23
_cell_length_b   6.23
_cell_length_c   7.17
_cell_angle_alpha   114.68
_cell_angle_beta   114.68
_cell_angle_gamma   30.44
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TlZn2
_chemical_formula_sum   'Tl2 Zn4'
_cell_volume   127.19
_cell_formula_units_Z   2
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  0.08  0.0  0.19  1.0
  Tl  Tl1  1  0.84  0.0  0.28  1.0
  Zn  Zn2  1  0.67  0.0  0.67  1.0
  Zn  Zn3  1  0.52  0.0  0.31  1.0
  Zn  Zn4  1  0.4  0.0  0.15  1.0
  Zn  Zn5  1  0.24  0.0  0.8  1.0

data_TlZn2
_symmetry_space_group_name_H-M   P-1
_cell_length_a   3.27
_cell_length_b   6.23
_cell_length_c   7.17
_cell_angle_alpha   114.68
_cell_angle_beta   90.0
_cell_angle_gamma   105.22
_symmetry_Int_Tables_number   2
_chemical_formula_structural   TlZn2
_chemical_formula_sum   'Tl2 Zn4'
_cell_volume   127.19
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '-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  2  0.0  0.12  0.46  1.0
  Zn  Zn1  2  0.0  0.29  0.06  1.0
  Zn  Zn2  2  0.0  0.44  0.42  1.0

Tl Tl Zn Zn Zn Zn