data_SrScIn2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.45
_cell_length_b   4.36
_cell_length_c   7.3
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrScIn2
_chemical_formula_sum   'Sr1 Sc1 In2'
_cell_volume   109.73
_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  Sr3  1  0.0  0.0  0.65  1.0
  Sc  Sc2  1  0.0  0.0  0.0  1.0
  In  In0  1  0.72  0.18  0.78  1.0
  In  In1  1  0.72  0.18  0.52  1.0

data_SrScIn2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.45
_cell_length_b   4.36
_cell_length_c   7.3
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrScIn2
_chemical_formula_sum   'Sr1 Sc1 In2'
_cell_volume   109.73
_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  0.65  1.0
  Sc  Sc1  1  0.0  0.0  0.0  1.0
  In  In2  1  0.72  0.18  0.52  1.0
  In  In3  1  0.72  0.18  0.78  1.0

Sr Sc In In