data_SrNbCo2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.49
_cell_length_b   3.75
_cell_length_c   6.26
_cell_angle_alpha   90.0
_cell_angle_beta   105.21
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrNbCo2
_chemical_formula_sum   'Sr1 Nb1 Co2'
_cell_volume   79.04
_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  0.49  0.0  0.82  1.0
  Nb  Nb2  1  0.1  0.88  0.07  1.0
  Co  Co0  1  0.85  0.88  0.42  1.0
  Co  Co1  1  0.81  0.0  0.75  1.0

data_SrNbCo2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.49
_cell_length_b   3.75
_cell_length_c   6.26
_cell_angle_alpha   90.0
_cell_angle_beta   105.21
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrNbCo2
_chemical_formula_sum   'Sr1 Nb1 Co2'
_cell_volume   79.04
_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  0.49  0.0  0.82  1.0
  Nb  Nb1  1  0.1  0.88  0.07  1.0
  Co  Co2  1  0.81  0.0  0.75  1.0
  Co  Co3  1  0.85  0.88  0.42  1.0

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