data_V5B3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.49
_cell_length_b   6.49
_cell_length_c   4.6
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   V5B3
_chemical_formula_sum   'V10 B6'
_cell_volume   167.7
_cell_formula_units_Z   2
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  V6  1  0.25  0.87  0.3  1.0
  V  V7  1  0.0  0.75  0.0  1.0
  V  V8  1  0.0  0.75  0.3  1.0
  V  V9  1  0.25  0.87  0.0  1.0
  V  V10  1  0.6  0.16  0.45  1.0
  V  V11  1  0.16  0.46  0.15  1.0
  V  V12  1  0.84  0.46  0.45  1.0
  V  V13  1  0.81  0.0  0.45  1.0
  V  V14  1  0.68  0.0  0.15  1.0
  V  V15  1  0.4  0.16  0.15  1.0
  B  B0  1  0.75  0.17  0.45  1.0
  B  B1  1  0.01  0.45  0.15  1.0
  B  B2  1  0.99  0.45  0.45  1.0
  B  B3  1  0.5  0.0  0.45  1.0
  B  B4  1  0.99  0.0  0.15  1.0
  B  B5  1  0.25  0.17  0.15  1.0

data_V5B3
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.6
_cell_length_b   6.49
_cell_length_c   6.49
_cell_angle_alpha   120.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   V5B3
_chemical_formula_sum   'V10 B6'
_cell_volume   167.7
_cell_formula_units_Z   2
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  0.0  0.75  1.0
  V  V1  1  0.0  0.25  0.87  1.0
  V  V2  1  0.15  0.16  0.46  1.0
  V  V3  1  0.15  0.4  0.16  1.0
  V  V4  1  0.15  0.68  0.0  1.0
  V  V5  1  0.3  0.0  0.75  1.0
  V  V6  1  0.3  0.25  0.87  1.0
  V  V7  1  0.45  0.6  0.16  1.0
  V  V8  1  0.45  0.81  0.0  1.0
  V  V9  1  0.45  0.84  0.46  1.0
  B  B10  1  0.15  0.01  0.45  1.0
  B  B11  1  0.15  0.25  0.17  1.0
  B  B12  1  0.15  0.99  0.0  1.0
  B  B13  1  0.45  0.5  0.0  1.0
  B  B14  1  0.45  0.75  0.17  1.0
  B  B15  1  0.45  0.99  0.45  1.0

V V V V V V V V V V B B B B B B