data_SrCo
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.95
_cell_length_b   5.95
_cell_length_c   4.08
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   134.36
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrCo
_chemical_formula_sum   'Sr2 Co2'
_cell_volume   103.25
_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  Sr2  1  0.31  0.45  0.02  1.0
  Sr  Sr3  1  0.31  0.55  0.06  1.0
  Co  Co0  1  0.31  0.91  0.02  1.0
  Co  Co1  1  0.31  0.09  0.06  1.0

data_SrCo
_symmetry_space_group_name_H-M   P-1
_cell_length_a   4.08
_cell_length_b   4.62
_cell_length_c   5.95
_cell_angle_alpha   112.82
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   2
_chemical_formula_structural   SrCo
_chemical_formula_sum   'Sr2 Co2'
_cell_volume   103.25
_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  0.02  0.45  0.45  1.0
  Co  Co1  2  0.02  0.91  0.91  1.0

Sr Sr Co Co
Sr Sr Co Co 0 1 o o o 2 3 o + o 