data_NbCo2Rh
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.61
_cell_length_b   4.61
_cell_length_c   4.59
_cell_angle_alpha   100.5
_cell_angle_beta   100.5
_cell_angle_gamma   34.63
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NbCo2Rh
_chemical_formula_sum   'Nb1 Co2 Rh1'
_cell_volume   54.43
_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
  Nb  Nb2  1  0.0  0.0  0.0  1.0
  Co  Co0  1  0.51  0.0  0.34  1.0
  Co  Co1  1  0.41  0.0  0.17  1.0
  Rh  Rh3  1  0.96  0.0  0.25  1.0

data_NbCo2Rh
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.74
_cell_length_b   4.59
_cell_length_c   4.61
_cell_angle_alpha   100.5
_cell_angle_beta   107.31
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NbCo2Rh
_chemical_formula_sum   'Nb1 Co2 Rh1'
_cell_volume   54.43
_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
  Nb  Nb0  1  0.0  0.0  0.0  1.0
  Co  Co1  1  0.0  0.17  0.41  1.0
  Co  Co2  1  0.0  0.34  0.51  1.0
  Rh  Rh3  1  0.0  0.25  0.96  1.0

Nb Co Co Rh
Nb Co Co Rh 0 3 - o o 1 2 o o o 