data_Nb2ZnMo
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.72
_cell_length_b   4.52
_cell_length_c   5.53
_cell_angle_alpha   90.0
_cell_angle_beta   101.32
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nb2ZnMo
_chemical_formula_sum   'Nb2 Zn1 Mo1'
_cell_volume   66.61
_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  Nb1  1  0.92  0.26  0.02  1.0
  Nb  Nb2  1  0.71  0.26  0.4  1.0
  Zn  Zn3  1  0.0  0.0  0.0  1.0
  Mo  Mo0  1  0.82  0.0  0.71  1.0

data_Nb2ZnMo
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.72
_cell_length_b   4.52
_cell_length_c   5.53
_cell_angle_alpha   90.0
_cell_angle_beta   101.32
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nb2ZnMo
_chemical_formula_sum   'Nb2 Zn1 Mo1'
_cell_volume   66.61
_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  0.71  0.26  0.4  1.0
  Nb  Nb1  1  0.92  0.26  0.02  1.0
  Zn  Zn2  1  0.0  0.0  0.0  1.0
  Mo  Mo3  1  0.82  0.0  0.71  1.0

Nb Nb Zn Mo
Nb Nb Zn Mo 0 2 + o o 0 1 o o o 1 3 o o o 2 3 - o - 