data_Ti2GaRh
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.21
_cell_length_b   5.21
_cell_length_c   5.21
_cell_angle_alpha   144.01
_cell_angle_beta   131.58
_cell_angle_gamma   61.79
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti2GaRh
_chemical_formula_sum   'Ti2 Ga1 Rh1'
_cell_volume   61.61
_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  0.0  0.0  0.86  1.0
  Ti  Ti3  1  0.61  0.0  0.21  1.0
  Ga  Ga0  1  0.0  0.0  0.57  1.0
  Rh  Rh1  1  0.0  0.14  0.27  1.0

data_Ti2GaRh
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.22
_cell_length_b   4.28
_cell_length_c   5.21
_cell_angle_alpha   114.21
_cell_angle_beta   108.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti2GaRh
_chemical_formula_sum   'Ti2 Ga1 Rh1'
_cell_volume   61.61
_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  0.0  0.21  0.59  1.0
  Ti  Ti1  1  0.0  0.86  0.86  1.0
  Ga  Ga2  1  0.0  0.57  0.57  1.0
  Rh  Rh3  1  0.86  0.13  0.13  1.0

Ti Ti Ga Rh