data_KBa2Rh
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.68
_cell_length_b   6.68
_cell_length_c   6.68
_cell_angle_alpha   135.4
_cell_angle_beta   135.4
_cell_angle_gamma   64.91
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KBa2Rh
_chemical_formula_sum   'K1 Ba2 Rh1'
_cell_volume   145.1
_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
  K  K2  1  0.0  0.0  0.0  1.0
  Ba  Ba0  1  0.0  0.0  0.64  1.0
  Ba  Ba1  1  0.0  0.54  0.82  1.0
  Rh  Rh3  1  0.54  0.0  0.82  1.0

data_KBa2Rh
_symmetry_space_group_name_H-M   P1
_cell_length_a   5.07
_cell_length_b   5.07
_cell_length_c   6.68
_cell_angle_alpha   112.3
_cell_angle_beta   112.3
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KBa2Rh
_chemical_formula_sum   'K1 Ba2 Rh1'
_cell_volume   145.1
_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
  K  K0  1  0.0  0.0  0.0  1.0
  Ba  Ba1  1  0.36  0.0  0.36  1.0
  Ba  Ba2  1  0.72  0.54  0.72  1.0
  Rh  Rh3  1  0.18  0.0  0.72  1.0

K Ba Ba Rh
KBa2Rh crystallizes in the triclinic P1 space group. K(1) is bonded in a distorted single-bond geometry to one Ba(1), one Ba(2), and one Rh(1) atom. The K(1)-Ba(1) bond length is 2.41 Å. The K(1)-Ba(2) bond length is 2.40 Å. The K(1)-Rh(1) bond length is 2.40 Å. There are two inequivalent Ba sites. In the first Ba site, Ba(1) is bonded in a 2-coordinate geometry to one K(1), one Ba(2), and one Rh(1) atom. The Ba(1)-Ba(2) bond length is 2.85 Å. The Ba(1)-Rh(1) bond length is 2.85 Å. In the second Ba site, Ba(2) is bonded in a 6-coordinate geometry to one K(1), one Ba(1), and four equivalent Rh(1) atoms. There are a spread of Ba(2)-Rh(1) bond distances ranging from 3.33-3.85 Å. Rh(1) is bonded in a 2-coordinate geometry to one K(1), one Ba(1), and four equivalent Ba(2) atoms.