data_LiRh2Se
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.13
_cell_length_b   5.13
_cell_length_c   2.82
_cell_angle_alpha   106.13
_cell_angle_beta   106.13
_cell_angle_gamma   114.31
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiRh2Se
_chemical_formula_sum   'Li1 Rh2 Se1'
_cell_volume   58.04
_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
  Rh  Rh1  1  0.67  0.85  0.21  1.0
  Rh  Rh2  1  0.67  0.15  0.21  1.0
  Se  Se3  1  0.78  0.0  0.0  1.0

data_LiRh2Se
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.82
_cell_length_b   4.78
_cell_length_c   5.12
_cell_angle_alpha   117.71
_cell_angle_beta   105.86
_cell_angle_gamma   90.31
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiRh2Se
_chemical_formula_sum   'Li1 Rh2 Se1'
_cell_volume   58.04
_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
  Rh  Rh1  1  0.63  0.33  0.18  1.0
  Rh  Rh2  1  0.94  0.33  0.49  1.0
  Se  Se3  1  -0.0  0.22  0.22  1.0

Li Rh Rh Se