data_LaHf2Pt
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.34
_cell_length_b   6.34
_cell_length_c   6.34
_cell_angle_alpha   149.54
_cell_angle_beta   131.37
_cell_angle_gamma   58.47
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaHf2Pt
_chemical_formula_sum   'La1 Hf2 Pt1'
_cell_volume   96.03
_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
  La  La2  1  0.0  0.0  0.0  1.0
  Hf  Hf0  1  0.0  0.61  0.29  1.0
  Hf  Hf1  1  0.66  0.0  0.24  1.0
  Pt  Pt3  1  0.0  0.0  0.53  1.0

data_LaHf2Pt
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.33
_cell_length_b   5.22
_cell_length_c   6.34
_cell_angle_alpha   114.32
_cell_angle_beta   105.23
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaHf2Pt
_chemical_formula_sum   'La1 Hf2 Pt1'
_cell_volume   96.03
_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
  La  La0  1  0.0  0.0  0.0  1.0
  Hf  Hf1  1  0.42  0.76  0.42  1.0
  Hf  Hf2  1  0.71  0.32  0.32  1.0
  Pt  Pt3  1  0.47  0.47  0.47  1.0

La Hf Hf Pt