data_Ba2NbRh
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.01
_cell_length_b   6.01
_cell_length_c   6.01
_cell_angle_alpha   132.39
_cell_angle_beta   132.39
_cell_angle_gamma   69.61
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba2NbRh
_chemical_formula_sum   'Ba2 Nb1 Rh1'
_cell_volume   116.09
_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  0.93  1.0
  Ba  Ba1  1  0.0  0.43  0.47  1.0
  Nb  Nb2  1  0.0  0.0  0.0  1.0
  Rh  Rh3  1  0.43  0.0  0.47  1.0

data_Ba2NbRh
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.85
_cell_length_b   4.85
_cell_length_c   6.01
_cell_angle_alpha   113.8
_cell_angle_beta   113.8
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba2NbRh
_chemical_formula_sum   'Ba2 Nb1 Rh1'
_cell_volume   116.09
_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  0.07  0.0  0.07  1.0
  Ba  Ba1  1  0.96  0.43  0.96  1.0
  Nb  Nb2  1  0.0  0.0  0.0  1.0
  Rh  Rh3  1  0.53  0.0  0.96  1.0

Ba Ba Nb Rh