data_V2RuPb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.02
_cell_length_b   3.02
_cell_length_c   7.39
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   93.17
_symmetry_Int_Tables_number   1
_chemical_formula_structural   V2RuPb
_chemical_formula_sum   'V2 Ru1 Pb1'
_cell_volume   67.05
_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  0.07  0.0  0.08  1.0
  V  V3  1  0.0  0.0  0.89  1.0
  Ru  Ru1  1  0.0  0.0  0.44  1.0
  Pb  Pb0  1  0.07  0.0  0.67  1.0

data_V2RuPb
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.02
_cell_length_b   3.02
_cell_length_c   7.39
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   93.17
_symmetry_Int_Tables_number   1
_chemical_formula_structural   V2RuPb
_chemical_formula_sum   'V2 Ru1 Pb1'
_cell_volume   67.05
_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  0.89  1.0
  V  V1  1  0.07  0.0  0.08  1.0
  Ru  Ru2  1  0.0  0.0  0.44  1.0
  Pb  Pb3  1  0.07  0.0  0.67  1.0

V V Ru Pb
V V Ru Pb 0 1 o o - 1 3 o o o 2 3 o o o 