data_SrTa2Al
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.95
_cell_length_b   2.95
_cell_length_c   9.86
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   93.12
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrTa2Al
_chemical_formula_sum   'Sr1 Ta2 Al1'
_cell_volume   85.47
_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
  Sr  Sr1  1  0.03  0.0  0.62  1.0
  Ta  Ta2  1  0.0  0.0  0.49  1.0
  Ta  Ta3  1  0.03  0.0  0.28  1.0
  Al  Al0  1  0.0  0.0  0.26  1.0

data_SrTa2Al
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.95
_cell_length_b   2.95
_cell_length_c   9.86
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   93.12
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrTa2Al
_chemical_formula_sum   'Sr1 Ta2 Al1'
_cell_volume   85.47
_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
  Sr  Sr0  1  0.03  0.0  0.62  1.0
  Ta  Ta1  1  0.0  0.0  0.49  1.0
  Ta  Ta2  1  0.03  0.0  0.28  1.0
  Al  Al3  1  0.0  0.0  0.26  1.0

Sr Ta Ta Al