data_Ta2MnAl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.92
_cell_length_b   3.9
_cell_length_c   5.61
_cell_angle_alpha   90.0
_cell_angle_beta   97.22
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta2MnAl
_chemical_formula_sum   'Ta2 Mn1 Al1'
_cell_volume   63.3
_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  Ta2  1  0.74  0.95  0.08  1.0
  Ta  Ta3  1  0.48  0.95  0.48  1.0
  Mn  Mn1  1  0.65  0.0  0.78  1.0
  Al  Al0  1  0.0  0.0  0.0  1.0

data_Ta2MnAl
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.92
_cell_length_b   3.9
_cell_length_c   5.61
_cell_angle_alpha   90.0
_cell_angle_beta   97.22
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta2MnAl
_chemical_formula_sum   'Ta2 Mn1 Al1'
_cell_volume   63.3
_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  0.48  0.95  0.48  1.0
  Ta  Ta1  1  0.74  0.95  0.08  1.0
  Mn  Mn2  1  0.65  0.0  0.78  1.0
  Al  Al3  1  0.0  0.0  0.0  1.0

Ta Ta Mn Al