data_SrRh3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.82
_cell_length_b   5.82
_cell_length_c   4.59
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   96.58
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrRh3
_chemical_formula_sum   'Sr2 Rh6'
_cell_volume   154.72
_cell_formula_units_Z   2
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
  Sr  Sr6  1  0.87  0.88  0.15  1.0
  Sr  Sr7  1  0.87  0.12  0.44  1.0
  Rh  Rh0  1  0.87  0.24  0.44  1.0
  Rh  Rh1  1  0.87  0.76  0.15  1.0
  Rh  Rh2  1  0.58  0.55  0.44  1.0
  Rh  Rh3  1  0.17  0.45  0.15  1.0
  Rh  Rh4  1  0.17  0.55  0.44  1.0
  Rh  Rh5  1  0.58  0.45  0.15  1.0

data_SrRh3
_symmetry_space_group_name_H-M   P-1
_cell_length_a   4.59
_cell_length_b   5.82
_cell_length_c   5.82
_cell_angle_alpha   96.58
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   2
_chemical_formula_structural   SrRh3
_chemical_formula_sum   'Sr2 Rh6'
_cell_volume   154.72
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '-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
  Sr  Sr0  2  0.15  0.5  0.12  1.0
  Rh  Rh1  2  0.15  0.21  0.55  1.0
  Rh  Rh2  2  0.15  0.5  0.24  1.0
  Rh  Rh3  2  0.15  0.79  0.55  1.0

Sr Sr Rh Rh Rh Rh Rh Rh
Sr Sr Rh Rh Rh Rh Rh Rh 0 3 o o o 1 2 o o o 4 7 o o o 5 6 o o o 