data_NaIn2Hg
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.86
_cell_length_b   5.86
_cell_length_c   3.37
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   114.29
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaIn2Hg
_chemical_formula_sum   'Na1 In2 Hg1'
_cell_volume   105.38
_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
  Na  Na3  1  0.0  0.0  0.0  1.0
  In  In1  1  0.59  0.54  0.69  1.0
  In  In2  1  0.59  0.46  0.69  1.0
  Hg  Hg0  1  0.18  0.0  0.0  1.0

data_NaIn2Hg
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.37
_cell_length_b   5.86
_cell_length_c   5.86
_cell_angle_alpha   114.29
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaIn2Hg
_chemical_formula_sum   'Na1 In2 Hg1'
_cell_volume   105.38
_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
  Na  Na0  1  0.0  0.0  0.0  1.0
  In  In1  1  0.69  0.59  0.46  1.0
  In  In2  1  0.69  0.59  0.54  1.0
  Hg  Hg3  1  0.0  0.18  0.0  1.0

Na In In Hg