data_SrGaRh2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.06
_cell_length_b   3.85
_cell_length_c   6.58
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrGaRh2
_chemical_formula_sum   'Sr1 Ga1 Rh2'
_cell_volume   77.52
_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
  Sr  Sr3  1  0.53  0.92  0.18  1.0
  Ga  Ga0  1  0.0  0.0  0.52  1.0
  Rh  Rh1  1  0.53  0.92  0.38  1.0
  Rh  Rh2  1  0.0  0.0  0.38  1.0

data_SrGaRh2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.06
_cell_length_b   3.85
_cell_length_c   6.58
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrGaRh2
_chemical_formula_sum   'Sr1 Ga1 Rh2'
_cell_volume   77.52
_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
  Sr  Sr0  1  0.53  0.92  0.18  1.0
  Ga  Ga1  1  0.0  0.0  0.52  1.0
  Rh  Rh2  1  0.0  0.0  0.38  1.0
  Rh  Rh3  1  0.53  0.92  0.38  1.0

Sr Ga Rh Rh
Sr Ga Rh Rh 0 2 o o o 1 3 o o o 2 3 o + o 2 3 + + o 