data_YRh2Pb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.29
_cell_length_b   5.48
_cell_length_c   5.48
_cell_angle_alpha   39.5
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YRh2Pb
_chemical_formula_sum   'Y1 Rh2 Pb1'
_cell_volume   81.78
_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  0.15  1.0
  Rh  Rh1  1  0.0  0.0  0.7  1.0
  Rh  Rh2  1  0.14  0.0  0.42  1.0
  Pb  Pb0  1  0.14  0.0  0.22  1.0

data_YRh2Pb
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.7
_cell_length_b   4.29
_cell_length_c   5.48
_cell_angle_alpha   90.0
_cell_angle_beta   109.75
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YRh2Pb
_chemical_formula_sum   'Y1 Rh2 Pb1'
_cell_volume   81.78
_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  0.85  0.0  0.85  1.0
  Rh  Rh1  1  0.3  0.0  0.3  1.0
  Rh  Rh2  1  0.58  0.14  0.58  1.0
  Pb  Pb3  1  0.78  0.14  0.78  1.0

Y Rh Rh Pb
Y Rh Rh Pb 0 3 o o o 1 2 o o o 2 3 o o o 