data_VBRu2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.93
_cell_length_b   2.93
_cell_length_c   5.66
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   VBRu2
_chemical_formula_sum   'V1 B1 Ru2'
_cell_volume   48.62
_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
  V  V3  1  0.47  0.47  0.94  1.0
  B  B0  1  0.0  0.0  0.32  1.0
  Ru  Ru1  1  0.47  0.47  0.23  1.0
  Ru  Ru2  1  0.0  0.0  0.65  1.0

data_VBRu2
_symmetry_space_group_name_H-M   Cm
_cell_length_a   4.15
_cell_length_b   4.15
_cell_length_c   5.66
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   VBRu2
_chemical_formula_sum   'V2 B2 Ru4'
_cell_volume   97.25
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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
  V  V0  2  0.47  0.0  0.94  1.0
  B  B1  2  0.0  0.0  0.32  1.0
  Ru  Ru2  2  0.0  0.0  0.65  1.0
  Ru  Ru3  2  0.47  0.0  0.23  1.0

V B Ru Ru
VRu2B crystallizes in the monoclinic Cm space group. V(1) is bonded in a distorted single-bond geometry to one Ru(1) and four equivalent Ru(2) atoms. The V(1)-Ru(1) bond length is 1.60 Å. There are a spread of V(1)-Ru(2) bond distances ranging from 2.53-2.75 Å. There are two inequivalent Ru sites. In the first Ru site, Ru(1) is bonded in a 5-coordinate geometry to one V(1) and four equivalent B(1) atoms. There are a spread of Ru(1)-B(1) bond distances ranging from 2.01-2.28 Å. In the second Ru site, Ru(2) is bonded in a 5-coordinate geometry to four equivalent V(1) and one B(1) atom. The Ru(2)-B(1) bond length is 1.87 Å. B(1) is bonded in a 5-coordinate geometry to one Ru(2) and four equivalent Ru(1) atoms.