data_V2CoSb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.66
_cell_length_b   4.66
_cell_length_c   2.94
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   113.43
_symmetry_Int_Tables_number   1
_chemical_formula_structural   V2CoSb
_chemical_formula_sum   'V2 Co1 Sb1'
_cell_volume   58.61
_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  0.28  0.95  0.47  1.0
  V  V3  1  0.28  0.05  0.47  1.0
  Co  Co0  1  0.0  0.0  0.0  1.0
  Sb  Sb1  1  0.56  0.0  0.0  1.0

data_V2CoSb
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.94
_cell_length_b   4.66
_cell_length_c   4.66
_cell_angle_alpha   113.43
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   V2CoSb
_chemical_formula_sum   'V2 Co1 Sb1'
_cell_volume   58.61
_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  0.47  0.28  0.05  1.0
  V  V1  1  0.47  0.28  0.95  1.0
  Co  Co2  1  0.0  0.0  0.0  1.0
  Sb  Sb3  1  0.0  0.56  0.0  1.0

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