data_NaTl2Ag
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.35
_cell_length_b   4.78
_cell_length_c   6.66
_cell_angle_alpha   90.0
_cell_angle_beta   103.01
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaTl2Ag
_chemical_formula_sum   'Na1 Tl2 Ag1'
_cell_volume   103.99
_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
  Na  Na1  1  0.0  0.0  0.0  1.0
  Tl  Tl2  1  0.58  0.39  0.73  1.0
  Tl  Tl3  1  0.27  0.39  0.76  1.0
  Ag  Ag0  1  0.25  0.0  0.24  1.0

data_NaTl2Ag
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.35
_cell_length_b   4.78
_cell_length_c   6.66
_cell_angle_alpha   90.0
_cell_angle_beta   103.01
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaTl2Ag
_chemical_formula_sum   'Na1 Tl2 Ag1'
_cell_volume   103.99
_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
  Na  Na0  1  0.0  0.0  0.0  1.0
  Tl  Tl1  1  0.27  0.39  0.76  1.0
  Tl  Tl2  1  0.58  0.39  0.73  1.0
  Ag  Ag3  1  0.25  0.0  0.24  1.0

Na Tl Tl Ag