data_TaCoAg2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.14
_cell_length_b   5.14
_cell_length_c   2.77
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   118.65
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaCoAg2
_chemical_formula_sum   'Ta1 Co1 Ag2'
_cell_volume   64.43
_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  0.62  0.0  0.0  1.0
  Co  Co2  1  0.0  0.0  0.0  1.0
  Ag  Ag0  1  0.31  0.79  0.39  1.0
  Ag  Ag1  1  0.31  0.21  0.39  1.0

data_TaCoAg2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.77
_cell_length_b   5.14
_cell_length_c   5.14
_cell_angle_alpha   118.65
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaCoAg2
_chemical_formula_sum   'Ta1 Co1 Ag2'
_cell_volume   64.43
_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  0.62  0.0  1.0
  Co  Co1  1  0.0  0.0  0.0  1.0
  Ag  Ag2  1  0.39  0.31  0.79  1.0
  Ag  Ag3  1  0.39  0.31  0.21  1.0

Ta Co Ag Ag