data_NbZnAg2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.77
_cell_length_b   4.03
_cell_length_c   6.13
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NbZnAg2
_chemical_formula_sum   'Nb1 Zn1 Ag2'
_cell_volume   68.4
_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
  Nb  Nb2  1  0.38  0.01  0.12  1.0
  Zn  Zn3  1  0.0  0.0  0.59  1.0
  Ag  Ag0  1  0.38  0.01  0.09  1.0
  Ag  Ag1  1  0.0  0.0  0.54  1.0

data_NbZnAg2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.77
_cell_length_b   4.03
_cell_length_c   6.13
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NbZnAg2
_chemical_formula_sum   'Nb1 Zn1 Ag2'
_cell_volume   68.4
_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
  Nb  Nb0  1  0.38  0.01  0.12  1.0
  Zn  Zn1  1  0.0  0.0  0.59  1.0
  Ag  Ag2  1  0.0  0.0  0.54  1.0
  Ag  Ag3  1  0.38  0.01  0.09  1.0

Nb Zn Ag Ag
Nb Zn Ag Ag 0 2 o o o 1 3 o o o 