data_Ta2NbRh
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.85
_cell_length_b   4.54
_cell_length_c   5.35
_cell_angle_alpha   90.0
_cell_angle_beta   99.96
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta2NbRh
_chemical_formula_sum   'Ta2 Nb1 Rh1'
_cell_volume   68.28
_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  Ta2  1  0.01  0.27  0.96  1.0
  Ta  Ta3  1  0.91  0.27  0.31  1.0
  Nb  Nb0  1  0.0  0.0  0.0  1.0
  Rh  Rh1  1  0.96  0.0  0.63  1.0

data_Ta2NbRh
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.85
_cell_length_b   4.54
_cell_length_c   5.35
_cell_angle_alpha   90.0
_cell_angle_beta   99.96
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta2NbRh
_chemical_formula_sum   'Ta2 Nb1 Rh1'
_cell_volume   68.28
_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  0.01  0.27  0.96  1.0
  Ta  Ta1  1  0.91  0.27  0.31  1.0
  Nb  Nb2  1  0.0  0.0  0.0  1.0
  Rh  Rh3  1  0.96  0.0  0.63  1.0

Ta Ta Nb Rh
Ta Ta Nb Rh 0 2 o o + 0 1 - o + 0 3 - o o 1 2 + o o 1 3 o o o 2 3 - o - 