data_BeNb2Pd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.8
_cell_length_b   2.8
_cell_length_c   7.6
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   92.22
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BeNb2Pd
_chemical_formula_sum   'Be1 Nb2 Pd1'
_cell_volume   59.41
_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
  Be  Be0  1  0.0  0.0  0.0  1.0
  Nb  Nb1  1  0.94  0.0  0.71  1.0
  Nb  Nb2  1  0.94  0.0  0.89  1.0
  Pd  Pd3  1  0.0  0.0  0.8  1.0

data_BeNb2Pd
_symmetry_space_group_name_H-M   Pm
_cell_length_a   2.8
_cell_length_b   2.8
_cell_length_c   7.6
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   6
_chemical_formula_structural   BeNb2Pd
_chemical_formula_sum   'Be1 Nb2 Pd1'
_cell_volume   59.45
_cell_formula_units_Z   1
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '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
  Be  Be0  1  0.0  0.0  0.0  1.0
  Nb  Nb1  1  0.94  0.0  0.71  1.0
  Nb  Nb2  1  0.94  0.0  0.89  1.0
  Pd  Pd3  1  0.0  0.0  0.8  1.0

Be Nb Nb Pd
BeNb2Pd is Indium-like structured and crystallizes in the monoclinic Pm space group. The structure is zero-dimensional and consists of one BeNb2Pd cluster. Be(1) is bonded in a single-bond geometry to one Nb(2) atom. The Be(1)-Nb(2) bond length is 0.83 Å. There are two inequivalent Nb sites. In the first Nb site, Nb(1) is bonded in a single-bond geometry to one Pd(1) atom. The Nb(1)-Pd(1) bond length is 0.73 Å. In the second Nb site, Nb(2) is bonded in a distorted bent 150 degrees geometry to one Be(1) and one Pd(1) atom. The Nb(2)-Pd(1) bond length is 0.73 Å. Pd(1) is bonded in a bent 150 degrees geometry to one Nb(1) and one Nb(2) atom.