data_HfInPt2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.18
_cell_length_b   5.18
_cell_length_c   5.18
_cell_angle_alpha   133.4
_cell_angle_beta   133.4
_cell_angle_gamma   68.03
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfInPt2
_chemical_formula_sum   'Hf1 In1 Pt2'
_cell_volume   72.03
_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  0.05  0.15  1.0
  In  In1  1  0.0  0.0  0.0  1.0
  Pt  Pt2  1  0.05  0.0  0.15  1.0
  Pt  Pt3  1  0.0  0.0  0.29  1.0

data_HfInPt2
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.1
_cell_length_b   4.1
_cell_length_c   5.18
_cell_angle_alpha   113.3
_cell_angle_beta   113.3
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfInPt2
_chemical_formula_sum   'Hf1 In1 Pt2'
_cell_volume   72.03
_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  0.1  0.15  0.1  1.0
  In  In1  1  0.0  0.0  0.0  1.0
  Pt  Pt2  1  0.15  0.1  0.1  1.0
  Pt  Pt3  1  0.29  0.29  0.29  1.0

Hf In Pt Pt