data_NiB2Rh
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.74
_cell_length_b   3.74
_cell_length_c   3.74
_cell_angle_alpha   124.24
_cell_angle_beta   112.01
_cell_angle_gamma   93.58
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NiB2Rh
_chemical_formula_sum   'Ni1 B2 Rh1'
_cell_volume   37.6
_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
  Ni  Ni2  1  0.0  0.0  0.0  1.0
  B  B0  1  0.75  0.0  0.04  1.0
  B  B1  1  0.0  0.09  0.53  1.0
  Rh  Rh3  1  0.0  0.0  0.56  1.0

data_NiB2Rh
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.5
_cell_length_b   3.74
_cell_length_c   3.74
_cell_angle_alpha   67.99
_cell_angle_beta   62.12
_cell_angle_gamma   62.12
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NiB2Rh
_chemical_formula_sum   'Ni1 B2 Rh1'
_cell_volume   37.6
_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
  Ni  Ni0  1  0.0  0.0  0.0  1.0
  B  B1  1  -0.0  0.25  0.04  1.0
  B  B2  1  0.09  0.0  0.43  1.0
  Rh  Rh3  1  -0.0  0.0  0.56  1.0

Ni B B Rh