data_KLiMn
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.84
_cell_length_b   6.84
_cell_length_c   6.84
_cell_angle_alpha   153.2
_cell_angle_beta   143.17
_cell_angle_gamma   46.13
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KLiMn
_chemical_formula_sum   'K1 Li1 Mn1'
_cell_volume   86.28
_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  0.58  1.0
  Li  Li1  1  0.0  0.0  0.01  1.0
  Mn  Mn2  1  0.0  0.0  0.59  1.0

data_KLiMn
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.17
_cell_length_b   4.32
_cell_length_c   6.84
_cell_angle_alpha   108.41
_cell_angle_beta   103.4
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KLiMn
_chemical_formula_sum   'K1 Li1 Mn1'
_cell_volume   86.28
_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  0.42  0.42  0.42  1.0
  Li  Li1  1  0.99  0.99  0.99  1.0
  Mn  Mn2  1  0.41  0.41  0.41  1.0

K Li Mn