data_KTlIn2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.9
_cell_length_b   3.9
_cell_length_c   8.59
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   92.08
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KTlIn2
_chemical_formula_sum   'K1 Tl1 In2'
_cell_volume   130.6
_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
  K  K2  1  0.0  0.0  0.33  1.0
  Tl  Tl3  1  0.71  0.0  0.75  1.0
  In  In0  1  0.0  0.0  0.52  1.0
  In  In1  1  0.71  0.0  0.87  1.0

data_KTlIn2
_symmetry_space_group_name_H-M   Pm
_cell_length_a   3.9
_cell_length_b   3.9
_cell_length_c   8.59
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   6
_chemical_formula_structural   KTlIn2
_chemical_formula_sum   'K1 Tl1 In2'
_cell_volume   130.69
_cell_formula_units_Z   1
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '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
  K  K0  1  0.0  0.0  0.33  1.0
  Tl  Tl1  1  0.71  0.0  0.75  1.0
  In  In2  1  0.0  0.0  0.52  1.0
  In  In3  1  0.71  0.0  0.87  1.0

K Tl In In