data_TlReSn2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.8
_cell_length_b   5.47
_cell_length_c   5.47
_cell_angle_alpha   39.52
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TlReSn2
_chemical_formula_sum   'Tl1 Re1 Sn2'
_cell_volume   91.36
_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  Tl3  1  0.4  0.0  0.8  1.0
  Re  Re0  1  0.0  0.0  0.7  1.0
  Sn  Sn1  1  0.4  0.0  0.98  1.0
  Sn  Sn2  1  0.0  0.0  0.05  1.0

data_TlReSn2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.7
_cell_length_b   4.8
_cell_length_c   5.47
_cell_angle_alpha   90.0
_cell_angle_beta   109.76
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TlReSn2
_chemical_formula_sum   'Tl1 Re1 Sn2'
_cell_volume   91.36
_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  0.2  0.4  0.2  1.0
  Re  Re1  1  0.3  0.0  0.3  1.0
  Sn  Sn2  1  0.02  0.4  0.02  1.0
  Sn  Sn3  1  0.95  0.0  0.95  1.0

Tl Re Sn Sn