data_BaBi2Rh
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.47
_cell_length_b   6.47
_cell_length_c   6.47
_cell_angle_alpha   147.78
_cell_angle_beta   123.95
_cell_angle_gamma   66.14
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaBi2Rh
_chemical_formula_sum   'Ba1 Bi2 Rh1'
_cell_volume   118.31
_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
  Ba  Ba0  1  0.0  0.0  0.42  1.0
  Bi  Bi1  1  0.79  0.0  0.13  1.0
  Bi  Bi2  1  0.0  0.04  0.29  1.0
  Rh  Rh3  1  0.0  0.0  0.0  1.0

data_BaBi2Rh
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.59
_cell_length_b   6.08
_cell_length_c   6.47
_cell_angle_alpha   118.03
_cell_angle_beta   106.11
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaBi2Rh
_chemical_formula_sum   'Ba1 Bi2 Rh1'
_cell_volume   118.31
_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
  Ba  Ba0  1  0.58  0.58  0.58  1.0
  Bi  Bi1  1  0.67  0.87  0.67  1.0
  Bi  Bi2  1  0.71  0.75  0.75  1.0
  Rh  Rh3  1  0.0  0.0  0.0  1.0

Ba Bi Bi Rh
Ba Bi Bi Rh 0 2 o o o 1 2 + o o 1 3 + o o 2 3 o o o 