data_Sr2NbCo
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.43
_cell_length_b   3.44
_cell_length_c   9.68
_cell_angle_alpha   90.0
_cell_angle_beta   90.94
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sr2NbCo
_chemical_formula_sum   'Sr2 Nb1 Co1'
_cell_volume   113.99
_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  0.34  0.0  0.67  1.0
  Sr  Sr3  1  0.86  0.72  0.51  1.0
  Nb  Nb1  1  0.56  0.72  0.31  1.0
  Co  Co0  1  0.28  0.0  0.03  1.0

data_Sr2NbCo
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.43
_cell_length_b   3.44
_cell_length_c   9.68
_cell_angle_alpha   90.0
_cell_angle_beta   90.94
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sr2NbCo
_chemical_formula_sum   'Sr2 Nb1 Co1'
_cell_volume   113.99
_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  0.34  0.0  0.67  1.0
  Sr  Sr1  1  0.86  0.72  0.51  1.0
  Nb  Nb2  1  0.56  0.72  0.31  1.0
  Co  Co3  1  0.28  0.0  0.03  1.0

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