data_VRhAu2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.95
_cell_length_b   4.95
_cell_length_c   4.73
_cell_angle_alpha   100.24
_cell_angle_beta   100.24
_cell_angle_gamma   33.74
_symmetry_Int_Tables_number   1
_chemical_formula_structural   VRhAu2
_chemical_formula_sum   'V1 Rh1 Au2'
_cell_volume   63.26
_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  0.0  0.0  0.0  1.0
  Rh  Rh2  1  0.29  0.0  0.33  1.0
  Au  Au0  1  0.86  0.0  0.14  1.0
  Au  Au1  1  0.73  0.0  0.51  1.0

data_VRhAu2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.87
_cell_length_b   4.73
_cell_length_c   4.95
_cell_angle_alpha   100.24
_cell_angle_beta   106.87
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   VRhAu2
_chemical_formula_sum   'V1 Rh1 Au2'
_cell_volume   63.26
_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  0.0  1.0
  Rh  Rh1  1  0.0  0.33  0.29  1.0
  Au  Au2  1  0.0  0.14  0.86  1.0
  Au  Au3  1  0.0  0.51  0.73  1.0

V Rh Au Au
V Rh Au Au 0 2 - o o 0 1 o o o 1 2 - o o 1 3 o o o 2 3 o o o 