data_NaNbCo2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.62
_cell_length_b   3.41
_cell_length_c   7.63
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaNbCo2
_chemical_formula_sum   'Na1 Nb1 Co2'
_cell_volume   68.02
_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
  Na  Na2  1  0.0  0.0  0.53  1.0
  Nb  Nb3  1  0.31  0.7  0.34  1.0
  Co  Co0  1  0.0  0.0  0.29  1.0
  Co  Co1  1  0.31  0.7  0.28  1.0

data_NaNbCo2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.62
_cell_length_b   3.41
_cell_length_c   7.63
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaNbCo2
_chemical_formula_sum   'Na1 Nb1 Co2'
_cell_volume   68.02
_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
  Na  Na0  1  0.0  0.0  0.53  1.0
  Nb  Nb1  1  0.31  0.7  0.34  1.0
  Co  Co2  1  0.0  0.0  0.29  1.0
  Co  Co3  1  0.31  0.7  0.28  1.0

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