data_Li2TiAg
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.7
_cell_length_b   4.88
_cell_length_c   5.11
_cell_angle_alpha   90.0
_cell_angle_beta   93.29
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2TiAg
_chemical_formula_sum   'Li2 Ti1 Ag1'
_cell_volume   67.22
_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
  Li  Li1  1  0.56  0.44  0.79  1.0
  Li  Li2  1  0.85  0.44  0.31  1.0
  Ti  Ti3  1  0.0  0.0  0.0  1.0
  Ag  Ag0  1  0.2  0.0  0.55  1.0

data_Li2TiAg
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.7
_cell_length_b   4.88
_cell_length_c   5.11
_cell_angle_alpha   90.0
_cell_angle_beta   93.29
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2TiAg
_chemical_formula_sum   'Li2 Ti1 Ag1'
_cell_volume   67.22
_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
  Li  Li0  1  0.56  0.44  0.79  1.0
  Li  Li1  1  0.85  0.44  0.31  1.0
  Ti  Ti2  1  0.0  0.0  0.0  1.0
  Ag  Ag3  1  0.2  0.0  0.55  1.0

Li Li Ti Ag
Li2TiAg crystallizes in the triclinic P1 space group. There are two inequivalent Li sites. In the first Li site, Li(1) is bonded in a 2-coordinate geometry to two equivalent Li(2), four equivalent Ti(1), and one Ag(1) atom. There is one shorter (2.60 Å) and one longer (2.76 Å) Li(1)-Li(2) bond length. There are a spread of Li(1)-Ti(1) bond distances ranging from 2.66-3.33 Å. The Li(1)-Ag(1) bond length is 2.62 Å. In the second Li site, Li(2) is bonded in a 9-coordinate geometry to two equivalent Li(1), two equivalent Li(2), two equivalent Ti(1), and three equivalent Ag(1) atoms. Both Li(2)-Li(2) bond lengths are 2.70 Å. There is one shorter (2.72 Å) and one longer (3.20 Å) Li(2)-Ti(1) bond length. There are a spread of Li(2)-Ag(1) bond distances ranging from 2.62-3.12 Å. Ti(1) is bonded in a 11-coordinate geometry to two equivalent Li(2), four equivalent Li(1), two equivalent Ti(1), and three equivalent Ag(1) atoms. Both Ti(1)-Ti(1) bond lengths are 2.70 Å. There are a spread of Ti(1)-Ag(1) bond distances ranging from 2.39-3.06 Å. Ag(1) is bonded in a 3-coordinate geometry to one Li(1), three equivalent Li(2), and three equivalent Ti(1) atoms.