data_TiAgRh
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.76
_cell_length_b   5.7
_cell_length_c   2.99
_cell_angle_alpha   75.93
_cell_angle_beta   73.83
_cell_angle_gamma   30.25
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TiAgRh
_chemical_formula_sum   'Ti1 Ag1 Rh1'
_cell_volume   47.43
_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  0.04  0.19  0.25  1.0
  Ag  Ag0  1  0.04  0.19  0.04  1.0
  Rh  Rh1  1  0.04  0.19  0.36  1.0

data_TiAgRh
_symmetry_space_group_name_H-M   Cm
_cell_length_a   4.07
_cell_length_b   10.65
_cell_length_c   2.99
_cell_angle_alpha   90.0
_cell_angle_beta   132.92
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   TiAgRh
_chemical_formula_sum   'Ti2 Ag2 Rh2'
_cell_volume   94.86
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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  2  0.02  0.5  0.71  1.0
  Ag  Ag1  2  0.24  0.5  0.93  1.0
  Rh  Rh2  2  0.42  0.0  0.61  1.0

Ti Ag Rh
Ti Ag Rh 0 2 o o o 0 1 o o o 