data_HfPtCl2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.69
_cell_length_b   3.69
_cell_length_c   8.38
_cell_angle_alpha   101.48
_cell_angle_beta   101.48
_cell_angle_gamma   59.56
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfPtCl2
_chemical_formula_sum   'Hf1 Pt1 Cl2'
_cell_volume   95.58
_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  Hf2  1  0.24  0.0  0.36  1.0
  Pt  Pt3  1  0.09  0.0  0.83  1.0
  Cl  Cl0  1  0.5  0.0  0.56  1.0
  Cl  Cl1  1  0.37  0.0  0.63  1.0

data_HfPtCl2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.66
_cell_length_b   3.69
_cell_length_c   8.38
_cell_angle_alpha   101.48
_cell_angle_beta   90.0
_cell_angle_gamma   119.78
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfPtCl2
_chemical_formula_sum   'Hf1 Pt1 Cl2'
_cell_volume   95.58
_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  0.76  0.64  1.0
  Pt  Pt1  1  0.0  0.91  0.17  1.0
  Cl  Cl2  1  0.0  0.5  0.44  1.0
  Cl  Cl3  1  0.0  0.63  0.37  1.0

Hf Pt Cl Cl