data_YTi2Rh
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.53
_cell_length_b   5.53
_cell_length_c   3.02
_cell_angle_alpha   100.11
_cell_angle_beta   100.11
_cell_angle_gamma   121.04
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YTi2Rh
_chemical_formula_sum   'Y1 Ti2 Rh1'
_cell_volume   73.89
_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
  Y  Y3  1  0.0  0.0  0.0  1.0
  Ti  Ti1  1  0.82  0.59  0.41  1.0
  Ti  Ti2  1  0.82  0.41  0.41  1.0
  Rh  Rh0  1  0.72  0.0  0.0  1.0

data_YTi2Rh
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.02
_cell_length_b   5.2
_cell_length_c   5.53
_cell_angle_alpha   114.41
_cell_angle_beta   100.11
_cell_angle_gamma   101.98
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YTi2Rh
_chemical_formula_sum   'Y1 Ti2 Rh1'
_cell_volume   73.89
_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
  Y  Y0  1  0.0  0.0  0.0  1.0
  Ti  Ti1  1  0.0  0.59  0.42  1.0
  Ti  Ti2  1  0.82  0.41  0.23  1.0
  Rh  Rh3  1  0.0  0.0  0.72  1.0

Y Ti Ti Rh