data_TbAgSn
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.85
_cell_length_b   4.85
_cell_length_c   7.48
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TbAgSn
_chemical_formula_sum   'Tb2 Ag2 Sn2'
_cell_volume   152.07
_cell_formula_units_Z   2
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
  Tb  Tb0  1  0.0  0.0  0.03  1.0
  Tb  Tb1  1  0.0  0.0  0.45  1.0
  Ag  Ag2  1  0.0  0.8  0.54  1.0
  Ag  Ag3  1  0.42  0.4  0.94  1.0
  Sn  Sn4  1  0.42  0.4  0.04  1.0
  Sn  Sn5  1  0.0  0.8  0.44  1.0

data_TbAgSn
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.85
_cell_length_b   4.85
_cell_length_c   7.48
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TbAgSn
_chemical_formula_sum   'Tb2 Ag2 Sn2'
_cell_volume   152.07
_cell_formula_units_Z   2
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
  Tb  Tb0  1  0.0  0.0  0.03  1.0
  Tb  Tb1  1  0.0  0.0  0.45  1.0
  Ag  Ag2  1  -0.0  0.8  0.54  1.0
  Ag  Ag3  1  0.42  0.4  0.94  1.0
  Sn  Sn4  1  -0.0  0.8  0.44  1.0
  Sn  Sn5  1  0.42  0.4  0.04  1.0

Tb Tb Ag Ag Sn Sn
Tb Tb Ag Ag Sn Sn 0 3 o o - 0 4 o o o 1 5 o - o 2 5 o o o 3 4 o o + 