data_LaAlHg
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.68
_cell_length_b   5.68
_cell_length_c   5.68
_cell_angle_alpha   144.06
_cell_angle_beta   132.33
_cell_angle_gamma   61.11
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaAlHg
_chemical_formula_sum   'La1 Al1 Hg1'
_cell_volume   78.69
_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  0.32  1.0
  Al  Al0  1  0.0  0.0  0.77  1.0
  Hg  Hg1  1  0.0  0.0  0.47  1.0

data_LaAlHg
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.5
_cell_length_b   4.59
_cell_length_c   5.68
_cell_angle_alpha   113.83
_cell_angle_beta   107.97
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaAlHg
_chemical_formula_sum   'La1 Al1 Hg1'
_cell_volume   78.69
_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  0.32  0.32  1.0
  Al  Al1  1  0.0  0.77  0.77  1.0
  Hg  Hg2  1  0.0  0.47  0.47  1.0

La Al Hg