data_Al2InHg
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.03
_cell_length_b   6.03
_cell_length_c   3.37
_cell_angle_alpha   105.77
_cell_angle_beta   105.77
_cell_angle_gamma   120.97
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al2InHg
_chemical_formula_sum   'Al2 In1 Hg1'
_cell_volume   87.5
_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
  Al  Al0  1  0.56  0.62  0.4  1.0
  Al  Al1  1  0.56  0.38  0.4  1.0
  In  In3  1  0.0  0.0  0.0  1.0
  Hg  Hg2  1  0.97  0.0  0.0  1.0

data_Al2InHg
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.37
_cell_length_b   4.95
_cell_length_c   6.03
_cell_angle_alpha   113.94
_cell_angle_beta   105.77
_cell_angle_gamma   91.06
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al2InHg
_chemical_formula_sum   'Al2 In1 Hg1'
_cell_volume   87.5
_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
  Al  Al0  1  0.03  0.62  0.18  1.0
  Al  Al1  1  0.78  0.38  0.93  1.0
  In  In2  1  0.0  0.0  0.0  1.0
  Hg  Hg3  1  0.0  0.0  0.97  1.0

Al Al In Hg