data_TaBRh2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.92
_cell_length_b   4.92
_cell_length_c   4.92
_cell_angle_alpha   146.56
_cell_angle_beta   126.53
_cell_angle_gamma   64.55
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaBRh2
_chemical_formula_sum   'Ta1 B1 Rh2'
_cell_volume   52.21
_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  0.0  0.0  0.16  1.0
  B  B0  1  0.0  0.0  0.0  1.0
  Rh  Rh1  1  0.0  0.21  0.51  1.0
  Rh  Rh2  1  0.42  0.0  0.65  1.0

data_TaBRh2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.83
_cell_length_b   4.43
_cell_length_c   4.92
_cell_angle_alpha   116.74
_cell_angle_beta   106.72
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaBRh2
_chemical_formula_sum   'Ta1 B1 Rh2'
_cell_volume   52.21
_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  0.84  0.84  0.84  1.0
  B  B1  1  0.0  0.0  0.0  1.0
  Rh  Rh2  1  0.49  0.7  0.7  1.0
  Rh  Rh3  1  0.77  0.35  0.77  1.0

Ta B Rh Rh