data_TaRhPb2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.19
_cell_length_b   4.45
_cell_length_c   6.01
_cell_angle_alpha   90.0
_cell_angle_beta   95.18
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaRhPb2
_chemical_formula_sum   'Ta1 Rh1 Pb2'
_cell_volume   84.99
_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
  Ta  Ta3  1  0.32  0.0  0.99  1.0
  Rh  Rh2  1  0.0  0.0  0.0  1.0
  Pb  Pb0  1  0.23  0.23  0.53  1.0
  Pb  Pb1  1  0.42  0.23  0.45  1.0

data_TaRhPb2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.19
_cell_length_b   4.45
_cell_length_c   6.01
_cell_angle_alpha   90.0
_cell_angle_beta   95.18
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaRhPb2
_chemical_formula_sum   'Ta1 Rh1 Pb2'
_cell_volume   84.99
_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
  Ta  Ta0  1  0.32  0.0  0.99  1.0
  Rh  Rh1  1  0.0  0.0  0.0  1.0
  Pb  Pb2  1  0.23  0.23  0.53  1.0
  Pb  Pb3  1  0.42  0.23  0.45  1.0

Ta Rh Pb Pb
Ta Rh Pb Pb 0 1 o o + 2 3 o o o 