data_TiAg2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.86
_cell_length_b   12.86
_cell_length_c   12.86
_cell_angle_alpha   161.54
_cell_angle_beta   161.54
_cell_angle_gamma   26.22
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TiAg2
_chemical_formula_sum   'Ti4 Ag8'
_cell_volume   213.03
_cell_formula_units_Z   4
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
  Ti  Ti8  1  0.0  0.0  0.18  1.0
  Ti  Ti9  1  0.0  0.0  0.87  1.0
  Ti  Ti10  1  0.0  0.06  0.44  1.0
  Ti  Ti11  1  0.0  0.06  0.08  1.0
  Ag  Ag0  1  0.0  0.0  0.23  1.0
  Ag  Ag1  1  0.0  0.0  0.81  1.0
  Ag  Ag2  1  0.0  0.06  0.5  1.0
  Ag  Ag3  1  0.0  0.06  0.03  1.0
  Ag  Ag4  1  0.0  0.0  0.44  1.0
  Ag  Ag5  1  0.0  0.0  0.61  1.0
  Ag  Ag6  1  0.06  0.0  0.18  1.0
  Ag  Ag7  1  0.06  0.0  0.34  1.0

data_TiAg2
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.12
_cell_length_b   4.12
_cell_length_c   12.86
_cell_angle_alpha   99.23
_cell_angle_beta   99.23
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TiAg2
_chemical_formula_sum   'Ti4 Ag8'
_cell_volume   213.03
_cell_formula_units_Z   4
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
  Ti  Ti0  1  0.13  0.0  0.13  1.0
  Ti  Ti1  1  0.62  0.06  0.62  1.0
  Ti  Ti2  1  0.82  0.0  0.82  1.0
  Ti  Ti3  1  0.98  0.06  0.98  1.0
  Ag  Ag4  1  0.03  0.06  0.03  1.0
  Ag  Ag5  1  0.19  0.0  0.19  1.0
  Ag  Ag6  1  0.39  0.0  0.39  1.0
  Ag  Ag7  1  0.56  0.0  0.56  1.0
  Ag  Ag8  1  0.57  0.06  0.57  1.0
  Ag  Ag9  1  0.66  0.0  0.72  1.0
  Ag  Ag10  1  0.77  0.0  0.77  1.0
  Ag  Ag11  1  0.82  0.0  0.88  1.0

Ti Ti Ti Ti Ag Ag Ag Ag Ag Ag Ag Ag