data_SrSmO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.35
_cell_length_b   6.35
_cell_length_c   6.35
_cell_angle_alpha   57.41
_cell_angle_beta   57.41
_cell_angle_gamma   57.41
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrSmO3
_chemical_formula_sum   'Sr2 Sm2 O6'
_cell_volume   170.28
_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  Sr8  1  0.0  0.0  0.78  1.0
  Sr  Sr9  1  0.0  0.0  0.08  1.0
  Sm  Sm6  1  0.0  0.0  0.28  1.0
  Sm  Sm7  1  0.0  0.0  0.57  1.0
  O  O0  1  0.68  0.12  0.67  1.0
  O  O1  1  0.29  0.79  0.67  1.0
  O  O2  1  0.03  0.09  0.67  1.0
  O  O3  1  0.97  0.91  0.18  1.0
  O  O4  1  0.71  0.21  0.18  1.0
  O  O5  1  0.32  0.88  0.18  1.0

data_SrSmO3
_symmetry_space_group_name_H-M   P-1
_cell_length_a   6.1
_cell_length_b   6.1
_cell_length_c   6.35
_cell_angle_alpha   61.29
_cell_angle_beta   61.29
_cell_angle_gamma   60.0
_symmetry_Int_Tables_number   2
_chemical_formula_structural   SrSmO3
_chemical_formula_sum   'Sr2 Sm2 O6'
_cell_volume   170.28
_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  0.0  0.15  0.35  1.0
  Sm  Sm1  2  0.0  0.36  0.14  1.0
  O  O2  2  0.09  0.75  0.63  1.0
  O  O3  2  0.12  0.75  0.96  1.0
  O  O4  2  0.21  0.25  0.34  1.0

Sr Sr Sm Sm O O O O O O