data_LaAg2Pd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.61
_cell_length_b   4.88
_cell_length_c   5.31
_cell_angle_alpha   90.0
_cell_angle_beta   105.32
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaAg2Pd
_chemical_formula_sum   'La1 Ag2 Pd1'
_cell_volume   90.26
_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
  La  La2  1  0.1  0.0  0.56  1.0
  Ag  Ag0  1  0.76  0.44  0.13  1.0
  Ag  Ag1  1  0.44  0.44  0.99  1.0
  Pd  Pd3  1  0.0  0.0  0.0  1.0

data_LaAg2Pd
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.61
_cell_length_b   4.88
_cell_length_c   5.31
_cell_angle_alpha   90.0
_cell_angle_beta   105.32
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaAg2Pd
_chemical_formula_sum   'La1 Ag2 Pd1'
_cell_volume   90.26
_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
  La  La0  1  0.1  0.0  0.56  1.0
  Ag  Ag1  1  0.44  0.44  0.99  1.0
  Ag  Ag2  1  0.76  0.44  0.13  1.0
  Pd  Pd3  1  0.0  0.0  0.0  1.0

La Ag Ag Pd
La Ag Ag Pd 0 3 o o o 0 3 o o + 0 1 - o o 0 2 o o o 1 2 o o - 1 3 + + o 1 3 + o o 2 3 + o + 2 3 o o + 
LaPdAg2 crystallizes in the triclinic P1 space group. La(1) is bonded in a 1-coordinate geometry to one Pd(1) and two equivalent Ag(1) atoms. The La(1)-Pd(1) bond length is 2.45 Å. There is one shorter (3.15 Å) and one longer (3.57 Å) La(1)-Ag(1) bond length. Pd(1) is bonded in a 1-coordinate geometry to one La(1) and two equivalent Ag(1) atoms. There is one shorter (2.48 Å) and one longer (3.00 Å) Pd(1)-Ag(1) bond length. There are two inequivalent Ag sites. In the first Ag site, Ag(1) is bonded in a 6-coordinate geometry to two equivalent La(1), two equivalent Pd(1), and two equivalent Ag(2) atoms. There is one shorter (1.18 Å) and one longer (2.74 Å) Ag(1)-Ag(2) bond length. In the second Ag site, Ag(2) is bonded in a 1-coordinate geometry to two equivalent Ag(1) atoms.