data_Hf2VPt
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.32
_cell_length_b   9.32
_cell_length_c   9.32
_cell_angle_alpha   18.85
_cell_angle_beta   18.85
_cell_angle_gamma   18.85
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hf2VPt
_chemical_formula_sum   'Hf2 V1 Pt1'
_cell_volume   73.85
_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  0.17  1.0
  Hf  Hf1  1  0.0  0.0  0.72  1.0
  V  V3  1  0.0  0.0  0.73  1.0
  Pt  Pt2  1  0.0  0.0  0.57  1.0

data_Hf2VPt
_symmetry_space_group_name_H-M   Cm
_cell_length_a   5.29
_cell_length_b   3.05
_cell_length_c   9.32
_cell_angle_alpha   90.0
_cell_angle_beta   100.9
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   Hf2VPt
_chemical_formula_sum   'Hf4 V2 Pt2'
_cell_volume   147.69
_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  -0.0  0.0  0.83  1.0
  Hf  Hf1  2  0.0  0.0  0.28  1.0
  V  V2  2  0.0  0.0  0.27  1.0
  Pt  Pt3  2  -0.0  0.0  0.43  1.0

Hf Hf V Pt
Hf Hf V Pt 0 0 o + - 0 0 + - o 0 0 + o - 1 2 o o o 1 3 o o o 2 3 o o o 