data_Na2YZn
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.38
_cell_length_b   4.93
_cell_length_c   6.6
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Na2YZn
_chemical_formula_sum   'Na2 Y1 Zn1'
_cell_volume   109.96
_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  0.69  0.47  0.47  1.0
  Na  Na1  1  0.69  0.47  0.13  1.0
  Y  Y2  1  0.0  0.0  0.3  1.0
  Zn  Zn3  1  0.0  0.0  0.0  1.0

data_Na2YZn
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.38
_cell_length_b   4.93
_cell_length_c   6.6
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Na2YZn
_chemical_formula_sum   'Na2 Y1 Zn1'
_cell_volume   109.96
_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  0.69  0.47  0.13  1.0
  Na  Na1  1  0.69  0.47  0.47  1.0
  Y  Y2  1  0.0  0.0  0.3  1.0
  Zn  Zn3  1  0.0  0.0  0.0  1.0

Na Na Y Zn
Na Na Y Zn 0 1 o o o 1 3 + o o 1 3 + + o 1 2 + o o 2 3 o o o 