data_Li2TlRh
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.84
_cell_length_b   4.84
_cell_length_c   4.84
_cell_angle_alpha   131.85
_cell_angle_beta   129.17
_cell_angle_gamma   72.61
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2TlRh
_chemical_formula_sum   'Li2 Tl1 Rh1'
_cell_volume   64.15
_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
  Li  Li0  1  0.0  0.0  0.02  1.0
  Li  Li1  1  0.98  0.0  0.95  1.0
  Tl  Tl3  1  0.0  0.08  0.96  1.0
  Rh  Rh2  1  0.0  0.0  0.88  1.0

data_Li2TlRh
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.95
_cell_length_b   4.16
_cell_length_c   4.84
_cell_angle_alpha   115.42
_cell_angle_beta   114.07
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2TlRh
_chemical_formula_sum   'Li2 Tl1 Rh1'
_cell_volume   64.15
_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
  Li  Li0  1  0.02  0.05  0.02  1.0
  Li  Li1  1  0.98  0.98  0.98  1.0
  Tl  Tl2  1  0.04  0.12  0.12  1.0
  Rh  Rh3  1  0.12  0.12  0.12  1.0

Li Li Tl Rh