data_V2CoB
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.76
_cell_length_b   4.76
_cell_length_c   4.04
_cell_angle_alpha   112.67
_cell_angle_beta   112.67
_cell_angle_gamma   30.49
_symmetry_Int_Tables_number   1
_chemical_formula_structural   V2CoB
_chemical_formula_sum   'V2 Co1 B1'
_cell_volume   42.5
_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  V2  1  0.05  0.0  0.04  1.0
  V  V3  1  0.8  0.0  0.6  1.0
  Co  Co1  1  0.87  0.0  0.05  1.0
  B  B0  1  0.63  0.0  0.86  1.0

data_V2CoB
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.5
_cell_length_b   4.04
_cell_length_c   4.76
_cell_angle_alpha   112.67
_cell_angle_beta   105.24
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   V2CoB
_chemical_formula_sum   'V2 Co1 B1'
_cell_volume   42.5
_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  0.04  0.05  1.0
  V  V1  1  0.0  0.6  0.8  1.0
  Co  Co2  1  0.0  0.05  0.87  1.0
  B  B3  1  0.0  0.86  0.63  1.0

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