data_Sr2ScPt
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.87
_cell_length_b   6.87
_cell_length_c   6.87
_cell_angle_alpha   148.43
_cell_angle_beta   130.32
_cell_angle_gamma   60.06
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sr2ScPt
_chemical_formula_sum   'Sr2 Sc1 Pt1'
_cell_volume   128.19
_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  0.0  0.89  0.91  1.0
  Sr  Sr3  1  0.0  0.0  0.65  1.0
  Sc  Sc1  1  0.0  0.0  0.0  1.0
  Pt  Pt0  1  0.0  0.89  0.28  1.0

data_Sr2ScPt
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.74
_cell_length_b   5.77
_cell_length_c   6.87
_cell_angle_alpha   114.84
_cell_angle_beta   105.78
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sr2ScPt
_chemical_formula_sum   'Sr2 Sc1 Pt1'
_cell_volume   128.19
_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  0.09  0.97  0.97  1.0
  Sr  Sr1  1  0.35  0.35  0.35  1.0
  Sc  Sc2  1  1.0  1.0  1.0  1.0
  Pt  Pt3  1  0.72  0.61  0.61  1.0

Sr Sr Sc Pt