data_TaAg2Hg
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.83
_cell_length_b   4.86
_cell_length_c   5.47
_cell_angle_alpha   90.0
_cell_angle_beta   93.07
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaAg2Hg
_chemical_formula_sum   'Ta1 Ag2 Hg1'
_cell_volume   75.11
_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  Ta3  1  0.0  0.0  0.0  1.0
  Ag  Ag0  1  0.9  0.43  0.29  1.0
  Ag  Ag1  1  0.63  0.43  0.17  1.0
  Hg  Hg2  1  0.27  0.0  0.73  1.0

data_TaAg2Hg
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.83
_cell_length_b   4.86
_cell_length_c   5.47
_cell_angle_alpha   90.0
_cell_angle_beta   93.07
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaAg2Hg
_chemical_formula_sum   'Ta1 Ag2 Hg1'
_cell_volume   75.11
_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  Ta0  1  0.0  0.0  0.0  1.0
  Ag  Ag1  1  0.63  0.43  0.17  1.0
  Ag  Ag2  1  0.9  0.43  0.29  1.0
  Hg  Hg3  1  0.27  0.0  0.73  1.0

Ta Ag Ag Hg