data_SrY2Sc
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.21
_cell_length_b   6.21
_cell_length_c   6.39
_cell_angle_alpha   99.94
_cell_angle_beta   99.94
_cell_angle_gamma   33.81
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrY2Sc
_chemical_formula_sum   'Sr1 Y2 Sc1'
_cell_volume   134.98
_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  0.37  0.0  0.14  1.0
  Y  Y2  1  0.53  0.0  0.41  1.0
  Y  Y3  1  0.21  0.0  0.87  1.0
  Sc  Sc0  1  0.0  0.0  0.0  1.0

data_SrY2Sc
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.61
_cell_length_b   6.21
_cell_length_c   6.39
_cell_angle_alpha   99.94
_cell_angle_beta   90.0
_cell_angle_gamma   106.9
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrY2Sc
_chemical_formula_sum   'Sr1 Y2 Sc1'
_cell_volume   134.98
_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  0.63  0.86  1.0
  Y  Y1  1  0.0  0.47  0.59  1.0
  Y  Y2  1  0.0  0.79  0.13  1.0
  Sc  Sc3  1  0.0  0.0  0.0  1.0

Sr Y Y Sc