data_Ti2GeRh
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.7
_cell_length_b   4.7
_cell_length_c   2.93
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   108.91
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti2GeRh
_chemical_formula_sum   'Ti2 Ge1 Rh1'
_cell_volume   61.14
_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
  Ti  Ti2  1  0.37  0.09  0.46  1.0
  Ti  Ti3  1  0.37  0.91  0.46  1.0
  Ge  Ge0  1  0.0  0.0  0.0  1.0
  Rh  Rh1  1  0.73  0.0  0.0  1.0

data_Ti2GeRh
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.93
_cell_length_b   4.7
_cell_length_c   4.7
_cell_angle_alpha   108.91
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti2GeRh
_chemical_formula_sum   'Ti2 Ge1 Rh1'
_cell_volume   61.14
_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
  Ti  Ti0  1  0.46  0.37  0.91  1.0
  Ti  Ti1  1  0.46  0.37  0.09  1.0
  Ge  Ge2  1  0.0  0.0  0.0  1.0
  Rh  Rh3  1  0.0  0.73  0.0  1.0

Ti Ti Ge Rh