data_Ba2SiRh
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.75
_cell_length_b   5.75
_cell_length_c   5.75
_cell_angle_alpha   130.01
_cell_angle_beta   126.07
_cell_angle_gamma   76.6
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba2SiRh
_chemical_formula_sum   'Ba2 Si1 Rh1'
_cell_volume   114.37
_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  0.61  0.15  1.0
  Ba  Ba1  1  0.43  0.0  0.37  1.0
  Si  Si3  1  0.0  0.0  0.0  1.0
  Rh  Rh2  1  0.0  0.0  0.51  1.0

data_Ba2SiRh
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.86
_cell_length_b   5.21
_cell_length_c   5.75
_cell_angle_alpha   116.96
_cell_angle_beta   114.99
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba2SiRh
_chemical_formula_sum   'Ba2 Si1 Rh1'
_cell_volume   114.37
_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  0.37  0.94  1.0
  Ba  Ba1  1  0.39  0.54  0.54  1.0
  Si  Si2  1  0.0  0.0  0.0  1.0
  Rh  Rh3  1  0.0  0.51  0.51  1.0

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