data_Nb2InW
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.35
_cell_length_b   5.35
_cell_length_c   3.09
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   109.46
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nb2InW
_chemical_formula_sum   'Nb2 In1 W1'
_cell_volume   83.25
_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
  Nb  Nb1  1  0.54  0.18  0.54  1.0
  Nb  Nb2  1  0.54  0.82  0.54  1.0
  In  In0  1  0.0  0.0  0.0  1.0
  W  W3  1  0.09  0.0  0.0  1.0

data_Nb2InW
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.09
_cell_length_b   5.35
_cell_length_c   5.35
_cell_angle_alpha   109.46
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nb2InW
_chemical_formula_sum   'Nb2 In1 W1'
_cell_volume   83.25
_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
  Nb  Nb0  1  0.54  0.54  0.18  1.0
  Nb  Nb1  1  0.54  0.54  0.82  1.0
  In  In2  1  0.0  0.0  0.0  1.0
  W  W3  1  0.0  0.09  0.0  1.0

Nb Nb In W
Nb Nb In W 0 1 o - o 2 3 o o o 
Nb2WIn crystallizes in the triclinic P1 space group. There are two inequivalent Nb sites. In the first Nb site, Nb(1) is bonded in a 3-coordinate geometry to two equivalent Nb(2) and two equivalent W(1) atoms. There is one shorter (1.96 Å) and one longer (3.39 Å) Nb(1)-Nb(2) bond length. There is one shorter (2.70 Å) and one longer (2.85 Å) Nb(1)-W(1) bond length. In the second Nb site, Nb(2) is bonded in a 8-coordinate geometry to two equivalent Nb(1), two equivalent Nb(2), two equivalent W(1), and two equivalent In(1) atoms. Both Nb(2)-Nb(2) bond lengths are 3.09 Å. There is one shorter (3.24 Å) and one longer (3.36 Å) Nb(2)-W(1) bond length. There is one shorter (2.70 Å) and one longer (2.85 Å) Nb(2)-In(1) bond length. W(1) is bonded in a single-bond geometry to two equivalent Nb(1), two equivalent Nb(2), and one In(1) atom. The W(1)-In(1) bond length is 0.47 Å. In(1) is bonded in a single-bond geometry to two equivalent Nb(2) and one W(1) atom.