data_LaTl2Ge
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.35
_cell_length_b   6.35
_cell_length_c   6.35
_cell_angle_alpha   141.72
_cell_angle_beta   135.31
_cell_angle_gamma   60.27
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaTl2Ge
_chemical_formula_sum   'La1 Tl2 Ge1'
_cell_volume   110.32
_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
  La  La1  1  0.0  0.0  0.49  1.0
  Tl  Tl2  1  0.08  0.0  0.53  1.0
  Tl  Tl3  1  0.0  0.41  0.96  1.0
  Ge  Ge0  1  0.0  0.0  0.0  1.0

data_LaTl2Ge
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.16
_cell_length_b   4.83
_cell_length_c   6.35
_cell_angle_alpha   112.35
_cell_angle_beta   109.14
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaTl2Ge
_chemical_formula_sum   'La1 Tl2 Ge1'
_cell_volume   110.32
_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
  La  La0  1  0.0  0.49  0.49  1.0
  Tl  Tl1  1  0.0  0.53  0.44  1.0
  Tl  Tl2  1  0.59  0.55  0.55  1.0
  Ge  Ge3  1  0.0  0.0  0.0  1.0

La Tl Tl Ge
La Tl Tl Ge 0 1 o o o 0 2 o - - 0 2 o o o 0 3 o o + 0 3 o o o 1 2 o o o 1 2 o - - 1 3 o o + 1 3 o o o 2 3 o o + 2 3 o + + 