data_NaAgB
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.63
_cell_length_b   5.63
_cell_length_c   5.63
_cell_angle_alpha   149.34
_cell_angle_beta   145.7
_cell_angle_gamma   46.66
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaAgB
_chemical_formula_sum   'Na1 Ag1 B1'
_cell_volume   51.16
_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  0.43  1.0
  Ag  Ag0  1  0.0  0.0  0.63  1.0
  B  B1  1  0.0  0.0  0.28  1.0

data_NaAgB
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.98
_cell_length_b   3.32
_cell_length_c   5.63
_cell_angle_alpha   107.15
_cell_angle_beta   105.33
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaAgB
_chemical_formula_sum   'Na1 Ag1 B1'
_cell_volume   51.16
_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  0.43  0.43  1.0
  Ag  Ag1  1  0.0  0.63  0.63  1.0
  B  B2  1  0.0  0.28  0.28  1.0

Na Ag B
Na Ag B 0 2 o o o 0 1 o o o 