data_Y2ScW
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.62
_cell_length_b   5.62
_cell_length_c   3.21
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   109.27
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Y2ScW
_chemical_formula_sum   'Y2 Sc1 W1'
_cell_volume   95.65
_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  Y2  1  0.63  0.71  0.6  1.0
  Y  Y3  1  0.63  0.29  0.6  1.0
  Sc  Sc0  1  0.0  0.0  0.0  1.0
  W  W1  1  0.25  0.0  0.0  1.0

data_Y2ScW
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.21
_cell_length_b   5.62
_cell_length_c   5.62
_cell_angle_alpha   109.27
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Y2ScW
_chemical_formula_sum   'Y2 Sc1 W1'
_cell_volume   95.65
_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  0.6  0.63  0.71  1.0
  Y  Y1  1  0.6  0.63  0.29  1.0
  Sc  Sc2  1  0.0  0.0  0.0  1.0
  W  W3  1  0.0  0.25  0.0  1.0

Y Y Sc W
Y2ScW crystallizes in the triclinic P1 space group. There are two inequivalent Y sites. In the first Y site, Y(1) is bonded in a 8-coordinate geometry to two equivalent Y(1), two equivalent Y(2), two equivalent Sc(1), and two equivalent W(1) atoms. Both Y(1)-Y(1) bond lengths are 3.21 Å. There is one shorter (2.34 Å) and one longer (3.28 Å) Y(1)-Y(2) bond length. There is one shorter (2.54 Å) and one longer (2.93 Å) Y(1)-Sc(1) bond length. There is one shorter (3.32 Å) and one longer (3.62 Å) Y(1)-W(1) bond length. In the second Y site, Y(2) is bonded in a 1-coordinate geometry to two equivalent Y(1) and one W(1) atom. The Y(2)-W(1) bond length is 2.54 Å. Sc(1) is bonded in a single-bond geometry to two equivalent Y(1) and one W(1) atom. The Sc(1)-W(1) bond length is 1.42 Å. W(1) is bonded in a 1-coordinate geometry to one Y(2), two equivalent Y(1), and one Sc(1) atom.