data_TaAgSn
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.28
_cell_length_b   7.14
_cell_length_c   2.99
_cell_angle_alpha   80.66
_cell_angle_beta   75.47
_cell_angle_gamma   23.87
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaAgSn
_chemical_formula_sum   'Ta1 Ag1 Sn1'
_cell_volume   59.92
_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
  Ta  Ta2  1  0.86  0.34  0.62  1.0
  Ag  Ag0  1  0.86  0.34  0.7  1.0
  Sn  Sn1  1  0.86  0.34  0.26  1.0

data_TaAgSn
_symmetry_space_group_name_H-M   Cm
_cell_length_a   3.72
_cell_length_b   13.79
_cell_length_c   2.99
_cell_angle_alpha   90.0
_cell_angle_beta   128.55
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   TaAgSn
_chemical_formula_sum   'Ta2 Ag2 Sn2'
_cell_volume   119.84
_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
  Ta  Ta0  2  0.12  0.5  0.48  1.0
  Ag  Ag1  2  0.2  0.5  0.56  1.0
  Sn  Sn2  2  0.26  0.0  0.12  1.0

Ta Ag Sn
Ta Ag Sn 0 1 o o o 0 2 o o o 