data_K2LiSc
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.92
_cell_length_b   7.92
_cell_length_c   7.92
_cell_angle_alpha   154.24
_cell_angle_beta   128.5
_cell_angle_gamma   58.45
_symmetry_Int_Tables_number   1
_chemical_formula_structural   K2LiSc
_chemical_formula_sum   'K2 Li1 Sc1'
_cell_volume   168.07
_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  0.0  0.0  0.71  1.0
  K  K1  1  0.77  0.0  0.86  1.0
  Li  Li2  1  0.0  0.0  0.22  1.0
  Sc  Sc3  1  0.0  0.44  0.86  1.0

data_K2LiSc
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.53
_cell_length_b   6.88
_cell_length_c   7.92
_cell_angle_alpha   115.75
_cell_angle_beta   102.88
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   K2LiSc
_chemical_formula_sum   'K2 Li1 Sc1'
_cell_volume   168.07
_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  0.29  0.29  0.29  1.0
  K  K1  1  0.9  0.14  0.9  1.0
  Li  Li2  1  0.78  0.78  0.78  1.0
  Sc  Sc3  1  0.14  0.58  0.58  1.0

K K Li Sc