data_SiP2Rh
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.41
_cell_length_b   6.41
_cell_length_c   6.41
_cell_angle_alpha   30.04
_cell_angle_beta   30.04
_cell_angle_gamma   30.04
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SiP2Rh
_chemical_formula_sum   'Si1 P2 Rh1'
_cell_volume   58.43
_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
  Si  Si3  1  0.0  0.0  0.0  1.0
  P  P0  1  0.0  0.0  0.72  1.0
  P  P1  1  0.0  0.0  0.62  1.0
  Rh  Rh2  1  0.0  0.0  0.17  1.0

data_SiP2Rh
_symmetry_space_group_name_H-M   Cm
_cell_length_a   5.75
_cell_length_b   3.32
_cell_length_c   6.41
_cell_angle_alpha   90.0
_cell_angle_beta   107.41
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   SiP2Rh
_chemical_formula_sum   'Si2 P4 Rh2'
_cell_volume   116.85
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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
  Si  Si0  2  0.0  0.0  0.0  1.0
  P  P1  2  0.0  0.0  0.28  1.0
  P  P2  2  0.0  0.0  0.38  1.0
  Rh  Rh3  2  0.0  0.0  0.83  1.0

Si P P Rh