data_Ta2MnZn
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.31
_cell_length_b   4.31
_cell_length_c   3.28
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   92.82
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta2MnZn
_chemical_formula_sum   'Ta2 Mn1 Zn1'
_cell_volume   60.65
_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
  Ta  Ta1  1  0.48  0.56  0.64  1.0
  Ta  Ta2  1  0.48  0.44  0.64  1.0
  Mn  Mn0  1  0.0  0.0  0.0  1.0
  Zn  Zn3  1  0.97  0.0  0.0  1.0

data_Ta2MnZn
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.28
_cell_length_b   4.31
_cell_length_c   4.31
_cell_angle_alpha   92.82
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta2MnZn
_chemical_formula_sum   'Ta2 Mn1 Zn1'
_cell_volume   60.65
_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
  Ta  Ta0  1  0.64  0.48  0.44  1.0
  Ta  Ta1  1  0.64  0.48  0.56  1.0
  Mn  Mn2  1  0.0  0.0  0.0  1.0
  Zn  Zn3  1  0.0  0.97  0.0  1.0

Ta Ta Mn Zn
Ta Ta Mn Zn 0 1 o o o 2 3 - o o 