data_LaV2Au
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.62
_cell_length_b   5.62
_cell_length_c   5.62
_cell_angle_alpha   146.43
_cell_angle_beta   127.84
_cell_angle_gamma   63.47
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaV2Au
_chemical_formula_sum   'La1 V2 Au1'
_cell_volume   76.73
_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
  La  La1  1  0.0  0.0  0.31  1.0
  V  V2  1  0.62  0.0  0.32  1.0
  V  V3  1  0.0  0.0  0.06  1.0
  Au  Au0  1  0.62  0.0  0.66  1.0

data_LaV2Au
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.25
_cell_length_b   4.94
_cell_length_c   5.62
_cell_angle_alpha   116.08
_cell_angle_beta   106.78
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaV2Au
_chemical_formula_sum   'La1 V2 Au1'
_cell_volume   76.73
_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
  La  La0  1  0.69  0.69  0.69  1.0
  V  V1  1  0.3  0.68  0.3  1.0
  V  V2  1  0.94  0.94  0.94  1.0
  Au  Au3  1  0.97  0.34  0.97  1.0

La V V Au