data_SrSc2Ta
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.34
_cell_length_b   5.34
_cell_length_c   6.86
_cell_angle_alpha   94.06
_cell_angle_beta   94.06
_cell_angle_gamma   34.36
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrSc2Ta
_chemical_formula_sum   'Sr1 Sc2 Ta1'
_cell_volume   109.91
_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  Sr2  1  0.81  0.0  0.3  1.0
  Sc  Sc0  1  0.04  0.0  0.19  1.0
  Sc  Sc1  1  0.21  0.0  0.58  1.0
  Ta  Ta3  1  0.47  0.0  0.18  1.0

data_SrSc2Ta
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.15
_cell_length_b   5.34
_cell_length_c   6.86
_cell_angle_alpha   94.06
_cell_angle_beta   90.0
_cell_angle_gamma   107.18
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrSc2Ta
_chemical_formula_sum   'Sr1 Sc2 Ta1'
_cell_volume   109.91
_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  0.19  0.7  1.0
  Sc  Sc1  1  0.0  0.79  0.42  1.0
  Sc  Sc2  1  0.0  0.96  0.81  1.0
  Ta  Ta3  1  0.0  0.53  0.82  1.0

Sr Sc Sc Ta