data_SrScSi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.56
_cell_length_b   6.56
_cell_length_c   6.56
_cell_angle_alpha   149.5
_cell_angle_beta   145.24
_cell_angle_gamma   46.91
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrScSi
_chemical_formula_sum   'Sr1 Sc1 Si1'
_cell_volume   81.27
_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  0.0  0.2  1.0
  Sc  Sc0  1  0.0  0.0  0.4  1.0
  Si  Si1  1  0.0  0.0  0.45  1.0

data_SrScSi
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.45
_cell_length_b   3.92
_cell_length_c   6.56
_cell_angle_alpha   107.38
_cell_angle_beta   105.25
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrScSi
_chemical_formula_sum   'Sr1 Sc1 Si1'
_cell_volume   81.27
_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  0.8  0.8  0.8  1.0
  Sc  Sc1  1  0.6  0.6  0.6  1.0
  Si  Si2  1  0.55  0.55  0.55  1.0

Sr Sc Si
Sr Sc Si 0 1 o o o 1 2 o o o 