data_TlRe2Ag
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.11
_cell_length_b   5.02
_cell_length_c   4.71
_cell_angle_alpha   90.0
_cell_angle_beta   93.51
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TlRe2Ag
_chemical_formula_sum   'Tl1 Re2 Ag1'
_cell_volume   73.24
_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  0.41  0.0  0.35  1.0
  Re  Re1  1  0.9  0.51  0.02  1.0
  Re  Re2  1  0.92  0.51  0.68  1.0
  Ag  Ag0  1  0.0  0.0  0.0  1.0

data_TlRe2Ag
_symmetry_space_group_name_H-M   Pm
_cell_length_a   3.11
_cell_length_b   5.02
_cell_length_c   4.71
_cell_angle_alpha   90.0
_cell_angle_beta   93.51
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   6
_chemical_formula_structural   TlRe2Ag
_chemical_formula_sum   'Tl1 Re2 Ag1'
_cell_volume   73.24
_cell_formula_units_Z   1
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  1  0.41  0.0  0.35  1.0
  Re  Re1  1  0.9  0.5  0.02  1.0
  Re  Re2  1  0.92  0.5  0.68  1.0
  Ag  Ag3  1  0.0  0.0  0.0  1.0

Tl Re Re Ag