data_VB3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.2
_cell_length_b   3.2
_cell_length_c   3.9
_cell_angle_alpha   105.27
_cell_angle_beta   105.27
_cell_angle_gamma   53.24
_symmetry_Int_Tables_number   1
_chemical_formula_structural   VB3
_chemical_formula_sum   'V1 B3'
_cell_volume   30.68
_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  0.29  0.0  0.87  1.0
  B  B0  1  0.0  0.0  0.0  1.0
  B  B1  1  0.07  0.0  0.47  1.0
  B  B2  1  0.5  0.0  0.26  1.0

data_VB3
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.87
_cell_length_b   3.2
_cell_length_c   3.9
_cell_angle_alpha   105.27
_cell_angle_beta   90.0
_cell_angle_gamma   116.62
_symmetry_Int_Tables_number   1
_chemical_formula_structural   VB3
_chemical_formula_sum   'V1 B3'
_cell_volume   30.68
_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  V0  1  0.0  0.71  0.13  1.0
  B  B1  1  0.0  0.0  0.0  1.0
  B  B2  1  0.0  0.5  0.74  1.0
  B  B3  1  0.0  0.93  0.53  1.0

V B B B
V B B B 0 1 o o + 0 2 o o o 0 3 o o + 1 2 o o o 1 3 o o o 2 3 - o o 2 3 o o o 