data_TlInRe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.05
_cell_length_b   8.88
_cell_length_c   2.89
_cell_angle_alpha   84.04
_cell_angle_beta   77.43
_cell_angle_gamma   18.53
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TlInRe
_chemical_formula_sum   'Tl1 In1 Re1'
_cell_volume   68.06
_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  0.63  0.39  0.47  1.0
  In  In0  1  0.63  0.39  0.42  1.0
  Re  Re1  1  0.63  0.39  0.57  1.0

data_TlInRe
_symmetry_space_group_name_H-M   Cm
_cell_length_a   3.27
_cell_length_b   17.46
_cell_length_c   2.89
_cell_angle_alpha   90.0
_cell_angle_beta   124.39
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   TlInRe
_chemical_formula_sum   'Tl2 In2 Re2'
_cell_volume   136.12
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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  0.13  0.5  0.1  1.0
  In  In1  2  0.13  0.5  0.05  1.0
  Re  Re2  2  0.13  0.5  0.21  1.0

Tl In Re
Tl In Re 0 1 o o o 0 2 o o o 