data_V2PdRu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.66
_cell_length_b   4.66
_cell_length_c   4.66
_cell_angle_alpha   99.69
_cell_angle_beta   99.69
_cell_angle_gamma   34.6
_symmetry_Int_Tables_number   1
_chemical_formula_structural   V2PdRu
_chemical_formula_sum   'V2 Pd1 Ru1'
_cell_volume   56.52
_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  0.06  0.0  0.45  1.0
  V  V3  1  0.46  0.0  0.24  1.0
  Pd  Pd0  1  0.06  0.0  0.17  1.0
  Ru  Ru1  1  0.61  0.0  0.6  1.0

data_V2PdRu
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.77
_cell_length_b   4.66
_cell_length_c   4.66
_cell_angle_alpha   99.69
_cell_angle_beta   107.3
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   V2PdRu
_chemical_formula_sum   'V2 Pd1 Ru1'
_cell_volume   56.52
_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  0.24  0.46  1.0
  V  V1  1  0.0  0.45  0.06  1.0
  Pd  Pd2  1  0.0  0.17  0.06  1.0
  Ru  Ru3  1  0.0  0.6  0.61  1.0

V V Pd Ru
V V Pd Ru 0 2 o o o 1 2 o o o 1 3 o o o 