data_Tl3Ge
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.37
_cell_length_b   6.37
_cell_length_c   6.37
_cell_angle_alpha   117.03
_cell_angle_beta   117.03
_cell_angle_gamma   117.03
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tl3Ge
_chemical_formula_sum   'Tl3 Ge1'
_cell_volume   113.67
_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  Tl1  1  0.0  0.14  0.11  1.0
  Tl  Tl2  1  0.28  0.43  0.11  1.0
  Tl  Tl3  1  0.72  0.43  0.11  1.0
  Ge  Ge0  1  0.0  0.0  0.0  1.0

data_Tl3Ge
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.33
_cell_length_b   6.37
_cell_length_c   6.37
_cell_angle_alpha   117.03
_cell_angle_beta   100.04
_cell_angle_gamma   100.04
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tl3Ge
_chemical_formula_sum   'Tl3 Ge1'
_cell_volume   113.67
_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  0.11  0.11  0.97  1.0
  Tl  Tl1  1  0.11  0.39  0.68  1.0
  Tl  Tl2  1  0.11  0.83  0.68  1.0
  Ge  Ge3  1  0.0  0.0  0.0  1.0

Tl Tl Tl Ge