data_HgB2Rh
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.83
_cell_length_b   5.83
_cell_length_c   5.83
_cell_angle_alpha   148.45
_cell_angle_beta   148.45
_cell_angle_gamma   45.23
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HgB2Rh
_chemical_formula_sum   'Hg1 B2 Rh1'
_cell_volume   53.99
_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
  Hg  Hg2  1  0.58  0.0  0.69  1.0
  B  B0  1  0.0  0.58  0.69  1.0
  B  B1  1  0.0  0.0  0.0  1.0
  Rh  Rh3  1  0.0  0.0  0.38  1.0

data_HgB2Rh
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.17
_cell_length_b   3.17
_cell_length_c   5.83
_cell_angle_alpha   105.78
_cell_angle_beta   105.78
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HgB2Rh
_chemical_formula_sum   'Hg1 B2 Rh1'
_cell_volume   53.99
_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
  Hg  Hg0  1  0.31  0.0  0.89  1.0
  B  B1  1  0.0  0.0  0.0  1.0
  B  B2  1  0.89  0.58  0.89  1.0
  Rh  Rh3  1  0.62  0.0  0.62  1.0

Hg B B Rh