data_SrScTa2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.99
_cell_length_b   5.99
_cell_length_c   2.93
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.22
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrScTa2
_chemical_formula_sum   'Sr1 Sc1 Ta2'
_cell_volume   90.71
_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  0.98  0.0  0.0  1.0
  Sc  Sc0  1  0.0  0.0  0.0  1.0
  Ta  Ta2  1  0.49  0.4  0.46  1.0
  Ta  Ta3  1  0.49  0.6  0.46  1.0

data_SrScTa2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.93
_cell_length_b   5.97
_cell_length_c   5.99
_cell_angle_alpha   119.89
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrScTa2
_chemical_formula_sum   'Sr1 Sc1 Ta2'
_cell_volume   90.71
_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  0.0  0.0  0.98  1.0
  Sc  Sc1  1  0.0  0.0  0.0  1.0
  Ta  Ta2  1  0.46  0.4  0.9  1.0
  Ta  Ta3  1  0.46  0.6  0.09  1.0

Sr Sc Ta Ta