data_V2CdIr
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.86
_cell_length_b   3.65
_cell_length_c   5.97
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   V2CdIr
_chemical_formula_sum   'V2 Cd1 Ir1'
_cell_volume   62.33
_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  0.0  0.0  0.93  1.0
  V  V3  1  0.43  0.82  0.28  1.0
  Cd  Cd0  1  0.0  0.0  0.97  1.0
  Ir  Ir1  1  0.43  0.82  0.74  1.0

data_V2CdIr
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.86
_cell_length_b   3.65
_cell_length_c   5.97
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   V2CdIr
_chemical_formula_sum   'V2 Cd1 Ir1'
_cell_volume   62.33
_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  0.0  0.93  1.0
  V  V1  1  0.43  0.82  0.28  1.0
  Cd  Cd2  1  0.0  0.0  0.97  1.0
  Ir  Ir3  1  0.43  0.82  0.74  1.0

V V Cd Ir
V V Cd Ir 0 2 o o o 0 1 o - + 0 1 - - + 0 3 o - o 0 3 - - o 1 2 o + - 1 2 + + - 1 1 + o o 1 3 o o o 2 3 o - o 2 3 - - o 