data_VBi2Au
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.72
_cell_length_b   5.72
_cell_length_c   5.32
_cell_angle_alpha   105.72
_cell_angle_beta   105.72
_cell_angle_gamma   34.02
_symmetry_Int_Tables_number   1
_chemical_formula_structural   VBi2Au
_chemical_formula_sum   'V1 Bi2 Au1'
_cell_volume   93.55
_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  0.47  0.0  0.68  1.0
  Bi  Bi1  1  0.09  0.0  0.28  1.0
  Bi  Bi2  1  0.44  0.0  0.49  1.0
  Au  Au0  1  0.16  0.0  0.2  1.0

data_VBi2Au
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.35
_cell_length_b   5.32
_cell_length_c   5.72
_cell_angle_alpha   105.72
_cell_angle_beta   107.01
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   VBi2Au
_chemical_formula_sum   'V1 Bi2 Au1'
_cell_volume   93.55
_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  0.68  0.47  1.0
  Bi  Bi1  1  0.0  0.28  0.09  1.0
  Bi  Bi2  1  0.0  0.49  0.44  1.0
  Au  Au3  1  0.0  0.2  0.16  1.0

V Bi Bi Au
V Bi Bi Au 0 2 o o o 1 3 o o o 