data_Li2BiRh
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.6
_cell_length_b   4.6
_cell_length_c   4.6
_cell_angle_alpha   121.19
_cell_angle_beta   121.19
_cell_angle_gamma   87.95
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2BiRh
_chemical_formula_sum   'Li2 Bi1 Rh1'
_cell_volume   67.46
_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  Li1  1  0.0  0.0  0.0  1.0
  Li  Li2  1  0.26  0.0  0.65  1.0
  Bi  Bi0  1  0.0  0.26  0.65  1.0
  Rh  Rh3  1  0.0  0.0  0.31  1.0

data_Li2BiRh
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.52
_cell_length_b   4.52
_cell_length_c   4.6
_cell_angle_alpha   119.4
_cell_angle_beta   119.4
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2BiRh
_chemical_formula_sum   'Li2 Bi1 Rh1'
_cell_volume   67.46
_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  0.0  1.0
  Li  Li1  1  0.35  0.0  0.6  1.0
  Bi  Bi2  1  0.6  0.26  0.6  1.0
  Rh  Rh3  1  0.69  0.0  0.69  1.0

Li Li Bi Rh
Li Li Bi Rh 0 3 o o o 1 3 o o o 1 2 o o o 2 3 o o o 