data_VPdRu2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.72
_cell_length_b   4.72
_cell_length_c   4.67
_cell_angle_alpha   100.59
_cell_angle_beta   100.59
_cell_angle_gamma   33.79
_symmetry_Int_Tables_number   1
_chemical_formula_structural   VPdRu2
_chemical_formula_sum   'V1 Pd1 Ru2'
_cell_volume   56.75
_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  V3  1  0.03  0.0  0.26  1.0
  Pd  Pd0  1  0.57  0.0  0.4  1.0
  Ru  Ru1  1  0.02  0.0  0.13  1.0
  Ru  Ru2  1  0.57  0.0  0.09  1.0

data_VPdRu2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.74
_cell_length_b   4.67
_cell_length_c   4.72
_cell_angle_alpha   100.59
_cell_angle_beta   106.9
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   VPdRu2
_chemical_formula_sum   'V1 Pd1 Ru2'
_cell_volume   56.75
_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  0.26  0.03  1.0
  Ru  Ru1  1  0.0  0.09  0.57  1.0
  Ru  Ru2  1  0.0  0.13  0.02  1.0
  Pd  Pd3  1  0.0  0.4  0.57  1.0

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