data_HfVRh
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.4
_cell_length_b   5.4
_cell_length_c   5.4
_cell_angle_alpha   146.07
_cell_angle_beta   146.07
_cell_angle_gamma   48.75
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfVRh
_chemical_formula_sum   'Hf1 V1 Rh1'
_cell_volume   48.94
_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
  Hf  Hf0  1  0.0  0.0  0.01  1.0
  V  V2  1  0.0  0.0  0.18  1.0
  Rh  Rh1  1  0.0  0.0  0.65  1.0

data_HfVRh
_symmetry_space_group_name_H-M   Cm
_cell_length_a   4.46
_cell_length_b   4.46
_cell_length_c   5.4
_cell_angle_alpha   90.0
_cell_angle_beta   114.37
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   HfVRh
_chemical_formula_sum   'Hf2 V2 Rh2'
_cell_volume   97.88
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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
  Hf  Hf0  2  0.01  0.0  0.01  1.0
  V  V1  2  0.18  0.0  0.18  1.0
  Rh  Rh2  2  0.15  0.5  0.65  1.0

Hf V Rh
Hf V Rh 0 1 o o o 0 2 o o - 