data_K4Sc
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.98
_cell_length_b   10.98
_cell_length_c   10.98
_cell_angle_alpha   151.19
_cell_angle_beta   151.19
_cell_angle_gamma   41.2
_symmetry_Int_Tables_number   1
_chemical_formula_structural   K4Sc
_chemical_formula_sum   'K4 Sc1'
_cell_volume   306.99
_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
  K  K0  1  0.73  0.0  0.14  1.0
  K  K1  1  0.0  0.73  0.14  1.0
  K  K2  1  0.0  0.0  0.08  1.0
  K  K3  1  0.0  0.0  0.48  1.0
  Sc  Sc4  1  0.0  0.0  0.0  1.0

data_K4Sc
_symmetry_space_group_name_H-M   Cm
_cell_length_a   7.73
_cell_length_b   7.73
_cell_length_c   10.98
_cell_angle_alpha   90.0
_cell_angle_beta   110.6
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   K4Sc
_chemical_formula_sum   'K8 Sc2'
_cell_volume   613.97
_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
  K  K0  4  0.37  0.37  0.59  1.0
  K  K1  2  0.0  0.0  0.52  1.0
  K  K2  2  0.0  0.0  0.92  1.0
  Sc  Sc3  2  0.0  0.0  0.0  1.0

K K K K Sc