data_Sr2PRh
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.21
_cell_length_b   6.21
_cell_length_c   4.97
_cell_angle_alpha   108.48
_cell_angle_beta   108.48
_cell_angle_gamma   34.72
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sr2PRh
_chemical_formula_sum   'Sr2 P1 Rh1'
_cell_volume   102.93
_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  Sr2  1  0.05  0.0  0.07  1.0
  Sr  Sr3  1  0.46  0.0  0.21  1.0
  P  P0  1  0.5  0.0  0.3  1.0
  Rh  Rh1  1  0.29  0.0  0.45  1.0

data_Sr2PRh
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.7
_cell_length_b   4.97
_cell_length_c   6.21
_cell_angle_alpha   108.48
_cell_angle_beta   107.36
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sr2PRh
_chemical_formula_sum   'Sr2 P1 Rh1'
_cell_volume   102.93
_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  0.0  0.07  0.05  1.0
  Sr  Sr1  1  0.0  0.21  0.46  1.0
  P  P2  1  0.0  0.3  0.5  1.0
  Rh  Rh3  1  0.0  0.45  0.29  1.0

Sr Sr P Rh
Sr Sr P Rh 0 1 o o o 0 3 o o o 1 2 o o o 1 3 o o o 2 3 o o o 