data_Sc8Os
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.93
_cell_length_b   6.93
_cell_length_c   6.93
_cell_angle_alpha   96.64
_cell_angle_beta   96.64
_cell_angle_gamma   140.24
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc8Os
_chemical_formula_sum   'Sc8 Os1'
_cell_volume   200.59
_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
  Sc  Sc1  1  0.43  0.57  0.36  1.0
  Sc  Sc2  1  0.57  0.43  0.36  1.0
  Sc  Sc3  1  0.0  0.36  0.0  1.0
  Sc  Sc4  1  0.18  0.18  0.0  1.0
  Sc  Sc5  1  0.36  0.0  0.0  1.0
  Sc  Sc6  1  0.43  0.43  0.36  1.0
  Sc  Sc7  1  0.0  0.86  0.0  1.0
  Sc  Sc8  1  0.86  0.0  0.0  1.0
  Os  Os0  1  0.0  0.0  0.0  1.0

data_Sc8Os
_symmetry_space_group_name_H-M   Cm
_cell_length_a   4.72
_cell_length_b   13.04
_cell_length_c   6.93
_cell_angle_alpha   90.0
_cell_angle_beta   109.88
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   Sc8Os
_chemical_formula_sum   'Sc16 Os2'
_cell_volume   401.17
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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
  Sc  Sc0  4  0.07  0.07  0.0  1.0
  Sc  Sc1  4  0.32  0.32  -0.0  1.0
  Sc  Sc2  4  0.36  0.43  0.36  1.0
  Sc  Sc3  2  0.32  0.5  -0.0  1.0
  Sc  Sc4  2  0.42  0.5  0.36  1.0
  Os  Os5  2  0.0  0.0  0.0  1.0

Sc Sc Sc Sc Sc Sc Sc Sc Os