data_YSc2Ag
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.25
_cell_length_b   6.25
_cell_length_c   3.25
_cell_angle_alpha   103.23
_cell_angle_beta   103.23
_cell_angle_gamma   120.33
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YSc2Ag
_chemical_formula_sum   'Y1 Sc2 Ag1'
_cell_volume   97.17
_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
  Y  Y3  1  0.0  0.0  0.0  1.0
  Sc  Sc1  1  0.81  0.29  0.44  1.0
  Sc  Sc2  1  0.81  0.71  0.44  1.0
  Ag  Ag0  1  0.11  0.0  0.0  1.0

data_YSc2Ag
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.25
_cell_length_b   5.54
_cell_length_c   6.25
_cell_angle_alpha   115.14
_cell_angle_beta   103.23
_cell_angle_gamma   93.99
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YSc2Ag
_chemical_formula_sum   'Y1 Sc2 Ag1'
_cell_volume   97.17
_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
  Y  Y0  1  0.0  0.0  0.0  1.0
  Sc  Sc1  1  0.15  0.71  0.52  1.0
  Sc  Sc2  1  0.73  0.29  0.1  1.0
  Ag  Ag3  1  0.0  0.0  0.11  1.0

Y Sc Sc Ag
YSc2Ag crystallizes in the triclinic P1 space group. Y(1) is bonded in a single-bond geometry to two equivalent Sc(1), two equivalent Sc(2), and one Ag(1) atom. There is one shorter (2.92 Å) and one longer (3.27 Å) Y(1)-Sc(1) bond length. There is one shorter (1.82 Å) and one longer (2.55 Å) Y(1)-Sc(2) bond length. The Y(1)-Ag(1) bond length is 0.69 Å. There are two inequivalent Sc sites. In the first Sc site, Sc(1) is bonded in a 6-coordinate geometry to two equivalent Y(1), one Sc(2), two equivalent Sc(1), and one Ag(1) atom. The Sc(1)-Sc(2) bond length is 2.64 Å. Both Sc(1)-Sc(1) bond lengths are 3.25 Å. The Sc(1)-Ag(1) bond length is 3.52 Å. In the second Sc site, Sc(2) is bonded in a 4-coordinate geometry to two equivalent Y(1), one Sc(1), and one Ag(1) atom. The Sc(2)-Ag(1) bond length is 1.90 Å. Ag(1) is bonded in a single-bond geometry to one Y(1), one Sc(1), and one Sc(2) atom.