data_Nb2ZnGa
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.02
_cell_length_b   5.02
_cell_length_c   2.81
_cell_angle_alpha   91.63
_cell_angle_beta   91.63
_cell_angle_gamma   112.01
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nb2ZnGa
_chemical_formula_sum   'Nb2 Zn1 Ga1'
_cell_volume   65.49
_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  0.33  0.92  0.4  1.0
  Nb  Nb2  1  0.33  0.08  0.4  1.0
  Zn  Zn3  1  0.0  0.0  0.0  1.0
  Ga  Ga0  1  0.81  0.0  0.0  1.0

data_Nb2ZnGa
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.81
_cell_length_b   5.02
_cell_length_c   5.02
_cell_angle_alpha   112.01
_cell_angle_beta   91.63
_cell_angle_gamma   91.63
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nb2ZnGa
_chemical_formula_sum   'Nb2 Zn1 Ga1'
_cell_volume   65.49
_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  0.4  0.33  0.92  1.0
  Nb  Nb1  1  0.4  0.33  0.08  1.0
  Zn  Zn2  1  0.0  0.0  0.0  1.0
  Ga  Ga3  1  0.0  0.81  0.0  1.0

Nb Nb Zn Ga